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Monoterpenoids

A diverse, modified class of terpenoids comprising two isoprene units and containing oxygen functionality or missing a methyl group; they have relevance to the pharmaceutical, cosmetic, agricultural, and food industries.

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1 – 15 of 28 results
1

alpha-Terpinene, 90+%

CAS: 99-86-5 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00001534 InChI Key: YHQGMYUVUMAZJR-UHFFFAOYSA-N Synonym: alpha-terpinene,p-mentha-1,3-diene,terpilene,1-isopropyl-4-methyl-1,3-cyclohexadiene,1,3-cyclohexadiene, 1-methyl-4-1-methylethyl,alpha-terpinen,1-methyl-4-1-methylethyl-1,3-cyclohexadiene,1-methyl-4-isopropylcyclohexadiene-1,3,.alpha.-terpinen,.alpha.-terpinene PubChem CID: 7462 ChEBI: CHEBI:10334 IUPAC Name: 1-methyl-4-propan-2-ylcyclohexa-1,3-diene SMILES: CC(C)C1=CC=C(C)CC1

PubChem CID 7462
CAS 99-86-5
Molecular Weight (g/mol) 136.24
ChEBI CHEBI:10334
MDL Number MFCD00001534
SMILES CC(C)C1=CC=C(C)CC1
Synonym alpha-terpinene,p-mentha-1,3-diene,terpilene,1-isopropyl-4-methyl-1,3-cyclohexadiene,1,3-cyclohexadiene, 1-methyl-4-1-methylethyl,alpha-terpinen,1-methyl-4-1-methylethyl-1,3-cyclohexadiene,1-methyl-4-isopropylcyclohexadiene-1,3,.alpha.-terpinen,.alpha.-terpinene
IUPAC Name 1-methyl-4-propan-2-ylcyclohexa-1,3-diene
InChI Key YHQGMYUVUMAZJR-UHFFFAOYSA-N
Molecular Formula C10H16
2
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Myrcene, 90%, tech., stabilized

CAS: 123-35-3 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 InChI Key: UAHWPYUMFXYFJY-UHFFFAOYSA-N Synonym: myrcene,beta-myrcene,7-methyl-3-methyleneocta-1,6-diene,7-methyl-3-methylene-1,6-octadiene,1,6-octadiene, 7-methyl-3-methylene,beta-geraniolene,.beta.-myrcene,2-methyl-6-methylene-2,7-octadiene,3-methylene-7-methyl-1,6-octadiene,myrcene natural PubChem CID: 31253 ChEBI: CHEBI:17221 IUPAC Name: 7-methyl-3-methylideneocta-1,6-diene SMILES: CC(=CCCC(=C)C=C)C

PubChem CID 31253
CAS 123-35-3
Molecular Weight (g/mol) 136.24
ChEBI CHEBI:17221
SMILES CC(=CCCC(=C)C=C)C
Synonym myrcene,beta-myrcene,7-methyl-3-methyleneocta-1,6-diene,7-methyl-3-methylene-1,6-octadiene,1,6-octadiene, 7-methyl-3-methylene,beta-geraniolene,.beta.-myrcene,2-methyl-6-methylene-2,7-octadiene,3-methylene-7-methyl-1,6-octadiene,myrcene natural
IUPAC Name 7-methyl-3-methylideneocta-1,6-diene
InChI Key UAHWPYUMFXYFJY-UHFFFAOYSA-N
Molecular Formula C10H16
3
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L(-)-Perillaldehyde, 90%

CAS: 18031-40-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00001543 InChI Key: RUMOYJJNUMEFDD-SNVBAGLBSA-N Synonym: --perillaldehyde,s---perillaldehyde,s-4-prop-1-en-2-yl cyclohex-1-enecarbaldehyde,l-perillaldehyde,s-p-mentha-1,8-dien-7-al,unii-5el0y7p6lp,--perillaaldehyde,perillaldehyde,-,s-4-isopropenyl-1-cyclohexene-1-carboxaldehyde,1-cyclohexene-1-carboxaldehyde, 4-1-methylethenyl-, 4s PubChem CID: 2724159 ChEBI: CHEBI:86938 IUPAC Name: (4S)-4-prop-1-en-2-ylcyclohexene-1-carbaldehyde SMILES: CC(=C)C1CCC(=CC1)C=O

PubChem CID 2724159
CAS 18031-40-8
Molecular Weight (g/mol) 150.22
ChEBI CHEBI:86938
MDL Number MFCD00001543
SMILES CC(=C)C1CCC(=CC1)C=O
Synonym --perillaldehyde,s---perillaldehyde,s-4-prop-1-en-2-yl cyclohex-1-enecarbaldehyde,l-perillaldehyde,s-p-mentha-1,8-dien-7-al,unii-5el0y7p6lp,--perillaaldehyde,perillaldehyde,-,s-4-isopropenyl-1-cyclohexene-1-carboxaldehyde,1-cyclohexene-1-carboxaldehyde, 4-1-methylethenyl-, 4s
IUPAC Name (4S)-4-prop-1-en-2-ylcyclohexene-1-carbaldehyde
InChI Key RUMOYJJNUMEFDD-SNVBAGLBSA-N
Molecular Formula C10H14O
4

4-Isopropylbenzaldehyde, tech. 90%

CAS: 122-03-2 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00006953 InChI Key: WTWBUQJHJGUZCY-UHFFFAOYSA-N Synonym: 4-isopropylbenzaldehyde,cuminaldehyde,cuminic aldehyde,cumaldehyde,cuminal,p-cumic aldehyde,cumic aldehyde,cuminyl aldehyde,p-isopropylbenzaldehyde,benzaldehyde, 4-1-methylethyl PubChem CID: 326 ChEBI: CHEBI:28671 SMILES: CC(C)C1=CC=C(C=O)C=C1

PubChem CID 326
CAS 122-03-2
Molecular Weight (g/mol) 148.21
ChEBI CHEBI:28671
MDL Number MFCD00006953
SMILES CC(C)C1=CC=C(C=O)C=C1
Synonym 4-isopropylbenzaldehyde,cuminaldehyde,cuminic aldehyde,cumaldehyde,cuminal,p-cumic aldehyde,cumic aldehyde,cuminyl aldehyde,p-isopropylbenzaldehyde,benzaldehyde, 4-1-methylethyl
InChI Key WTWBUQJHJGUZCY-UHFFFAOYSA-N
Molecular Formula C10H12O
5
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3-Carene, 90%, stabilized

CAS: 13466-78-9 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.23 MDL Number: MFCD00001315 InChI Key: BQOFWKZOCNGFEC-UHFFFAOYSA-N Synonym: 3-carene,carene,3,7,7-trimethylbicyclo 4.1.0 hept-3-ene,delta-3-carene,monoterpenes,alpha-carene,bicyclo 4.1.0 hept-3-ene, 3,7,7-trimethyl,+--delta3-carene,+ car-3-ene,+--3-carene PubChem CID: 26049 ChEBI: CHEBI:35661 IUPAC Name: 4,7,7-trimethylbicyclo[4.1.0]hept-3-ene SMILES: CC1=CCC2C(C1)C2(C)C

PubChem CID 26049
CAS 13466-78-9
Molecular Weight (g/mol) 136.23
ChEBI CHEBI:35661
MDL Number MFCD00001315
SMILES CC1=CCC2C(C1)C2(C)C
Synonym 3-carene,carene,3,7,7-trimethylbicyclo 4.1.0 hept-3-ene,delta-3-carene,monoterpenes,alpha-carene,bicyclo 4.1.0 hept-3-ene, 3,7,7-trimethyl,+--delta3-carene,+ car-3-ene,+--3-carene
IUPAC Name 4,7,7-trimethylbicyclo[4.1.0]hept-3-ene
InChI Key BQOFWKZOCNGFEC-UHFFFAOYSA-N
Molecular Formula C10H16
6
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alpha-Terpinene, 90%, tech.

CAS: 99-86-5 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00001534 InChI Key: YHQGMYUVUMAZJR-UHFFFAOYSA-N Synonym: alpha-terpinene,p-mentha-1,3-diene,terpilene,1-isopropyl-4-methyl-1,3-cyclohexadiene,1,3-cyclohexadiene, 1-methyl-4-1-methylethyl,alpha-terpinen,1-methyl-4-1-methylethyl-1,3-cyclohexadiene,1-methyl-4-isopropylcyclohexadiene-1,3,.alpha.-terpinen,.alpha.-terpinene PubChem CID: 7462 ChEBI: CHEBI:10334 IUPAC Name: 1-methyl-4-propan-2-ylcyclohexa-1,3-diene SMILES: CC(C)C1=CC=C(C)CC1

PubChem CID 7462
CAS 99-86-5
Molecular Weight (g/mol) 136.24
ChEBI CHEBI:10334
MDL Number MFCD00001534
SMILES CC(C)C1=CC=C(C)CC1
Synonym alpha-terpinene,p-mentha-1,3-diene,terpilene,1-isopropyl-4-methyl-1,3-cyclohexadiene,1,3-cyclohexadiene, 1-methyl-4-1-methylethyl,alpha-terpinen,1-methyl-4-1-methylethyl-1,3-cyclohexadiene,1-methyl-4-isopropylcyclohexadiene-1,3,.alpha.-terpinen,.alpha.-terpinene
IUPAC Name 1-methyl-4-propan-2-ylcyclohexa-1,3-diene
InChI Key YHQGMYUVUMAZJR-UHFFFAOYSA-N
Molecular Formula C10H16
7
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Isobornyl methacrylate, 85-90%, stabilized

CAS: 7534-94-3 Molecular Formula: C14H22O2 Molecular Weight (g/mol): 222.33 MDL Number: MFCD00081070 InChI Key: IAXXETNIOYFMLW-UHFFFAOYNA-N Synonym: ibma,isobornyl methacrylate,methacrylic acid isobornyl ester,iso-bornyl methacrylate,isobornyl methacrylate, technical grade,isobornyl methacrylate, stabilized with mehq,exo-1,7,7-trimethylbicyclo 2.2.1 hept-,2-yl methacrylate,1r,4r-1,7,7-trimethylbicyclo 2.2.1 heptan-2-yl 2-methylprop-2-enoate PubChem CID: 71311141 IUPAC Name: [(1R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OC1CC2CCC1(C)C2(C)C

PubChem CID 71311141
CAS 7534-94-3
Molecular Weight (g/mol) 222.33
MDL Number MFCD00081070
SMILES CC(=C)C(=O)OC1CC2CCC1(C)C2(C)C
Synonym ibma,isobornyl methacrylate,methacrylic acid isobornyl ester,iso-bornyl methacrylate,isobornyl methacrylate, technical grade,isobornyl methacrylate, stabilized with mehq,exo-1,7,7-trimethylbicyclo 2.2.1 hept-,2-yl methacrylate,1r,4r-1,7,7-trimethylbicyclo 2.2.1 heptan-2-yl 2-methylprop-2-enoate
IUPAC Name [(1R,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-methylprop-2-enoate
InChI Key IAXXETNIOYFMLW-UHFFFAOYNA-N
Molecular Formula C14H22O2
8

Terpineol (>90%), TRC

CAS: 8000-41-7 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 Synonym: Terpineol,Alpha Jax,Terpineol 318,Terpineol C,Terpineol LW IUPAC Name: 1-methyl-4-(prop-1-en-2-yl)cyclohexan-1-ol--1-methyl-4-(propan-2-ylidene)cyclohexan-1-ol--2-(4-methylcyclohex-3-en-1-yl)propan-2-ol (1/1/1) SMILES: CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2

CAS 8000-41-7
Molecular Weight (g/mol) 154.25
SMILES CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2
Synonym Terpineol,Alpha Jax,Terpineol 318,Terpineol C,Terpineol LW
IUPAC Name 1-methyl-4-(prop-1-en-2-yl)cyclohexan-1-ol--1-methyl-4-(propan-2-ylidene)cyclohexan-1-ol--2-(4-methylcyclohex-3-en-1-yl)propan-2-ol (1/1/1)
Molecular Formula C10H18O
9

(+)-Camphene (>90%), TRC

CAS: 5794-03-6 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.23 Synonym: (1R)-2,2-Dimethyl-3-methylene-bicyclo[2.2.1]heptane,(1R,4S)-(+)-Camphene (8CI),(1R,4S)-2,2-Dimethyl-3-methylenebicyclo[2.2.1]heptane,(1R)-Camphene,(1R,4S)-Camphene,d-Camphene IUPAC Name: (1S,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptane SMILES: CC1(C)[C@@H]2CC[C@@H](C2)C1=C

CAS 5794-03-6
Molecular Weight (g/mol) 136.23
SMILES CC1(C)[C@@H]2CC[C@@H](C2)C1=C
Synonym (1R)-2,2-Dimethyl-3-methylene-bicyclo[2.2.1]heptane,(1R,4S)-(+)-Camphene (8CI),(1R,4S)-2,2-Dimethyl-3-methylenebicyclo[2.2.1]heptane,(1R)-Camphene,(1R,4S)-Camphene,d-Camphene
IUPAC Name (1S,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptane
Molecular Formula C10H16
10

(R)-Pulegone (>90%), TRC

CAS: 89-82-7 Molecular Formula: C10 H16 O Molecular Weight (g/mol): 152.23 Synonym: (+)-(R)-Pulegone,Cyclohexanone, 5-methyl-2-(1-methylethylidene)-, (5R)-,Cyclohexanone, 5-methyl-2-(1-methylethylidene)-, (R)-,p-Menth-4(8)-en-3-one, (R)-(+)- (8CI),(5R)-5-Methyl-2-(1-methylethylidene)cyclohexanone,(+)-Pulegone,(1R)-(+)-p-Menth-4(8)-en-3-one,(1R)-Pulegone,(R)-(+)-Pulegone,(R)-(+)-p-Menth-4(8)-en-3-one,(R)-Pulegone,L-Pulegone,NSC 15334,Pulegon,Pulegone,d-Pulegone IUPAC Name: (5R)-5-methyl-2-propan-2-ylidenecyclohexan-1-one SMILES: C[C@@H]1CCC(=C(C)C)C(=O)C1

CAS 89-82-7
Molecular Weight (g/mol) 152.23
SMILES C[C@@H]1CCC(=C(C)C)C(=O)C1
Synonym (+)-(R)-Pulegone,Cyclohexanone, 5-methyl-2-(1-methylethylidene)-, (5R)-,Cyclohexanone, 5-methyl-2-(1-methylethylidene)-, (R)-,p-Menth-4(8)-en-3-one, (R)-(+)- (8CI),(5R)-5-Methyl-2-(1-methylethylidene)cyclohexanone,(+)-Pulegone,(1R)-(+)-p-Menth-4(8)-en-3-one,(1R)-Pulegone,(R)-(+)-Pulegone,(R)-(+)-p-Menth-4(8)-en-3-one,(R)-Pulegone,L-Pulegone,NSC 15334,Pulegon,Pulegone,d-Pulegone
IUPAC Name (5R)-5-methyl-2-propan-2-ylidenecyclohexan-1-one
Molecular Formula C10 H16 O
11

rac-Citronellal (>90%), TRC

CAS: 106-23-0 Molecular Formula: C10 H18 O Molecular Weight (g/mol): 154.25 Synonym: 6-Octenal, 3,7-dimethyl-,3,7-Dimethyl-6-octenal,(±)-Citronellal,2,3-Dihydrocitral,2,6-Dimethylhept-5-enecarboxaldehyde,3,7-Dimethyloct-6-en-1-al,Citronellal,NSC 46106,Rac-citronellal,Rhodinal,dl-Citronellal,rac-Citronellal,β-Citronellal,(±)-beta-Citronellal IUPAC Name: 3,7-dimethyloct-6-enal SMILES: CC(CCC=C(C)C)CC=O

CAS 106-23-0
Molecular Weight (g/mol) 154.25
SMILES CC(CCC=C(C)C)CC=O
Synonym 6-Octenal, 3,7-dimethyl-,3,7-Dimethyl-6-octenal,(±)-Citronellal,2,3-Dihydrocitral,2,6-Dimethylhept-5-enecarboxaldehyde,3,7-Dimethyloct-6-en-1-al,Citronellal,NSC 46106,Rac-citronellal,Rhodinal,dl-Citronellal,rac-Citronellal,β-Citronellal,(±)-beta-Citronellal
IUPAC Name 3,7-dimethyloct-6-enal
Molecular Formula C10 H18 O
12

(1R,2R,3R,5S)-(-)-Isopinocampheylamine, 95%

CAS: 69460-11-3 Molecular Formula: C10H19N Molecular Weight (g/mol): 153.27 InChI Key: VPTSZLVPZCTAHZ-BZNPZCIMSA-N Synonym: 1r,2r,3r,5s---isopinocampheylamine,1r,2r,3r,5s-2,6,6-trimethylbicyclo 3.1.1 heptan-3-amine,bicyclo 3.1.1 heptan-3-amine, 2,6,6-trimethyl-, 1r,2r,3r,5s,--isopinocampheylamine,--isopinocampheyl amine,1r,2r,3r,5s-3-pinanamine,1r,2r,5s-pinane-3alpha-amine,--isopinocampheylamine; 1r,2r,3r,5s-3-pinanamine,1r,2r,3r,5s-2,6,6-trimeth-ylbicyclo 3.1.1 heptane-3-amine PubChem CID: 11744832 IUPAC Name: (1S,3R,4R,5R)-4,6,6-trimethylbicyclo[3.1.1]heptan-3-amine SMILES: CC1C2CC(C2(C)C)CC1N

PubChem CID 11744832
CAS 69460-11-3
Molecular Weight (g/mol) 153.27
SMILES CC1C2CC(C2(C)C)CC1N
Synonym 1r,2r,3r,5s---isopinocampheylamine,1r,2r,3r,5s-2,6,6-trimethylbicyclo 3.1.1 heptan-3-amine,bicyclo 3.1.1 heptan-3-amine, 2,6,6-trimethyl-, 1r,2r,3r,5s,--isopinocampheylamine,--isopinocampheyl amine,1r,2r,3r,5s-3-pinanamine,1r,2r,5s-pinane-3alpha-amine,--isopinocampheylamine; 1r,2r,3r,5s-3-pinanamine,1r,2r,3r,5s-2,6,6-trimeth-ylbicyclo 3.1.1 heptane-3-amine
IUPAC Name (1S,3R,4R,5R)-4,6,6-trimethylbicyclo[3.1.1]heptan-3-amine
InChI Key VPTSZLVPZCTAHZ-BZNPZCIMSA-N
Molecular Formula C10H19N
13

4-Isopropylbenzonitrile, 95%

CAS: 13816-33-6 Molecular Formula: C10H11N Molecular Weight (g/mol): 145.205 MDL Number: MFCD00052966 InChI Key: YFDJCWXBKWRDPW-UHFFFAOYSA-N Synonym: 4-isopropylbenzonitrile,cuminyl nitrile,p-cyanocumene,benzonitrile, 4-1-methylethyl,cuminonitrile,cuminic nitrile,p-isopropylbenzonitrile,benzonitrile, p-isopropyl,4-1-methylethyl benzonitrile,4-propan-2-yl benzonitrile PubChem CID: 26289 IUPAC Name: 4-propan-2-ylbenzonitrile SMILES: CC(C)C1=CC=C(C=C1)C#N

PubChem CID 26289
CAS 13816-33-6
Molecular Weight (g/mol) 145.205
MDL Number MFCD00052966
SMILES CC(C)C1=CC=C(C=C1)C#N
Synonym 4-isopropylbenzonitrile,cuminyl nitrile,p-cyanocumene,benzonitrile, 4-1-methylethyl,cuminonitrile,cuminic nitrile,p-isopropylbenzonitrile,benzonitrile, p-isopropyl,4-1-methylethyl benzonitrile,4-propan-2-yl benzonitrile
IUPAC Name 4-propan-2-ylbenzonitrile
InChI Key YFDJCWXBKWRDPW-UHFFFAOYSA-N
Molecular Formula C10H11N
14
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Menthone, 97%, mixture of isomers

EDGE
15

(-)-Borneol, 97+%

CAS: 464-45-9 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00003759,MFCD00066426,MFCD00066427 InChI Key: DTGKSKDOIYIVQL-NQMVMOMDSA-N Synonym: --borneol,borneol,l-borneol,1s,2r,4s-1,7,7-trimethylbicyclo 2.2.1 heptan-2-ol,linderol,1s-endo---borneol,borneo camphor,bornyl alcohol,sumatra camphor,dl-borneol PubChem CID: 1201518 ChEBI: CHEBI:15394 SMILES: CC1(C)[C@@H]2CC[C@]1(C)[C@H](O)C2

PubChem CID 1201518
CAS 464-45-9
Molecular Weight (g/mol) 154.25
ChEBI CHEBI:15394
MDL Number MFCD00003759,MFCD00066426,MFCD00066427
SMILES CC1(C)[C@@H]2CC[C@]1(C)[C@H](O)C2
Synonym --borneol,borneol,l-borneol,1s,2r,4s-1,7,7-trimethylbicyclo 2.2.1 heptan-2-ol,linderol,1s-endo---borneol,borneo camphor,bornyl alcohol,sumatra camphor,dl-borneol
InChI Key DTGKSKDOIYIVQL-NQMVMOMDSA-N
Molecular Formula C10H18O