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Aromatic hydrocarbons

Organic compounds made up entirely of hydrogen and carbon elements usually organized in a chain, and have an aromatic (aryl) functional group.

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1

2-Phenylindene, Thermo Scientific Chemicals

CAS: 4505-48-0 Molecular Formula: C15H12 Molecular Weight (g/mol): 192.26 MDL Number: MFCD00239514 InChI Key: BSBXLZYWGGAVHD-UHFFFAOYSA-N IUPAC Name: 2-phenyl-1H-indene SMILES: C1C2=CC=CC=C2C=C1C1=CC=CC=C1

CAS 4505-48-0
Molecular Weight (g/mol) 192.26
MDL Number MFCD00239514
SMILES C1C2=CC=CC=C2C=C1C1=CC=CC=C1
IUPAC Name 2-phenyl-1H-indene
InChI Key BSBXLZYWGGAVHD-UHFFFAOYSA-N
Molecular Formula C15H12
2

Dodecylbenzene, mixture of isomers

CAS: 123-01-3 Molecular Formula: C18H30 Molecular Weight (g/mol): 246.438 MDL Number: MFCD00008974 InChI Key: KWKXNDCHNDYVRT-UHFFFAOYSA-N Synonym: 1-phenyldodecane,benzene, dodecyl,n-dodecylbenzene,laurylbenzene,phenyldodecane,marlican,dodecane, 1-phenyl,detergent alkylate,alkylate p 1,phenyldodecan PubChem CID: 31237 IUPAC Name: dodecylbenzene SMILES: CCCCCCCCCCCCC1=CC=CC=C1

PubChem CID 31237
CAS 123-01-3
Molecular Weight (g/mol) 246.438
MDL Number MFCD00008974
SMILES CCCCCCCCCCCCC1=CC=CC=C1
Synonym 1-phenyldodecane,benzene, dodecyl,n-dodecylbenzene,laurylbenzene,phenyldodecane,marlican,dodecane, 1-phenyl,detergent alkylate,alkylate p 1,phenyldodecan
IUPAC Name dodecylbenzene
InChI Key KWKXNDCHNDYVRT-UHFFFAOYSA-N
Molecular Formula C18H30
3

Bis(cyclopentadienyl)titanium dichloride, 99+%

CAS: 1271-19-8 Molecular Formula: C10H10Cl2Ti-2 Molecular Weight (g/mol): 248.957 MDL Number: MFCD00003723 InChI Key: MKNXBRLZBFVUPV-UHFFFAOYSA-L Synonym: Dichlorobis(cyclopentadienyl)titanium; Titanocene dichloride PubChem CID: 124040768 IUPAC Name: cyclopenta-1,3-diene;titanium(2+);dichloride SMILES: [CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Cl-].[Ti+2]

PubChem CID 124040768
CAS 1271-19-8
Molecular Weight (g/mol) 248.957
MDL Number MFCD00003723
SMILES [CH-]1C=CC=C1.[CH-]1C=CC=C1.[Cl-].[Cl-].[Ti+2]
Synonym Dichlorobis(cyclopentadienyl)titanium; Titanocene dichloride
IUPAC Name cyclopenta-1,3-diene;titanium(2+);dichloride
InChI Key MKNXBRLZBFVUPV-UHFFFAOYSA-L
Molecular Formula C10H10Cl2Ti-2
4

Bis(pentamethylcyclopentadienyl)zirconium dichloride, 99%, Thermo Scientific Chemicals

CAS: 54039-38-2 Molecular Formula: C20H30Cl2Zr-2 Molecular Weight (g/mol): 432.584 MDL Number: MFCD00058849 InChI Key: OCFSLQKTBFSWPL-UHFFFAOYSA-L Synonym: decamethylzirconocene dichloride PubChem CID: 57369741 IUPAC Name: dichlorozirconium;1,2,3,4,5-pentamethylcyclopenta-1,3-diene SMILES: C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.Cl[Zr]Cl

PubChem CID 57369741
CAS 54039-38-2
Molecular Weight (g/mol) 432.584
MDL Number MFCD00058849
SMILES C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.Cl[Zr]Cl
Synonym decamethylzirconocene dichloride
IUPAC Name dichlorozirconium;1,2,3,4,5-pentamethylcyclopenta-1,3-diene
InChI Key OCFSLQKTBFSWPL-UHFFFAOYSA-L
Molecular Formula C20H30Cl2Zr-2
5

Hexamethylbenzene, 99+%

CAS: 87-85-4 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.276 MDL Number: MFCD00008523 InChI Key: YUWFEBAXEOLKSG-UHFFFAOYSA-N Synonym: hexamethylbenzene,mellitene,benzene, hexamethyl,hexamethylbenzol,hexamethyl benzene,unii-j8sd5741v8,1,2,3,4,5,6-hexamethyl-benzene,benzene, 1,2,3,4,5,6-hexamethyl,hexamethyl-benzene,hexamethylbenxene; PubChem CID: 6908 ChEBI: CHEBI:39001 IUPAC Name: 1,2,3,4,5,6-hexamethylbenzene SMILES: CC1=C(C(=C(C(=C1C)C)C)C)C

PubChem CID 6908
CAS 87-85-4
Molecular Weight (g/mol) 162.276
ChEBI CHEBI:39001
MDL Number MFCD00008523
SMILES CC1=C(C(=C(C(=C1C)C)C)C)C
Synonym hexamethylbenzene,mellitene,benzene, hexamethyl,hexamethylbenzol,hexamethyl benzene,unii-j8sd5741v8,1,2,3,4,5,6-hexamethyl-benzene,benzene, 1,2,3,4,5,6-hexamethyl,hexamethyl-benzene,hexamethylbenxene;
IUPAC Name 1,2,3,4,5,6-hexamethylbenzene
InChI Key YUWFEBAXEOLKSG-UHFFFAOYSA-N
Molecular Formula C12H18
6

Dichloro(pentamethylcyclopentadienyl)iridium(III) dimer

CAS: 12354-84-6 Molecular Formula: C20H30Cl4Ir2 Molecular Weight (g/mol): 796.694 MDL Number: MFCD00075435 InChI Key: MMAGMBCAIFVRGJ-UHFFFAOYSA-J Synonym: unii-6oy4uuc534,dichloro pentamethylcyclopentadienyl iridium iii dimer,pentamethylcyclopentadienyl iridium iii dichloride dimer,pentamethylcyclopentadienyliridium dichloride,pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer,eta5-pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer mi,bis mu-chloro chloro eta5-pentamethylcyclopentadienyl iridium,iridium, di-mu-chlorodichlorobis 1,2,3,4,5-eta-1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl di PubChem CID: 76030743 IUPAC Name: iridium(3+);1,2,3,4,5-pentamethylcyclopenta-1,3-diene;tetrachloride SMILES: C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ir+3].[Ir+3]

PubChem CID 76030743
CAS 12354-84-6
Molecular Weight (g/mol) 796.694
MDL Number MFCD00075435
SMILES C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ir+3].[Ir+3]
Synonym unii-6oy4uuc534,dichloro pentamethylcyclopentadienyl iridium iii dimer,pentamethylcyclopentadienyl iridium iii dichloride dimer,pentamethylcyclopentadienyliridium dichloride,pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer,eta5-pentamethylcyclopentadienyl iridium dichloride dimer,pentamethylcyclopentadienyliridium iii dichloride dimer mi,bis mu-chloro chloro eta5-pentamethylcyclopentadienyl iridium,iridium, di-mu-chlorodichlorobis 1,2,3,4,5-eta-1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl di
IUPAC Name iridium(3+);1,2,3,4,5-pentamethylcyclopenta-1,3-diene;tetrachloride
InChI Key MMAGMBCAIFVRGJ-UHFFFAOYSA-J
Molecular Formula C20H30Cl4Ir2
7

2-Phenylpentane, tech. 85%

CAS: 2719-52-0 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.25 MDL Number: MFCD00027145 InChI Key: LTHAIAJHDPJXLG-UHFFFAOYNA-N Synonym: 2-phenylpentane,sec-pentylbenzene,benzene, sec-pentyl,sec-amylbenzene,benzene, 1-methylbutyl,1-phenyl-1-methylbutane,s-amylbenzene,d-2-phenyl-pentane,sec-amyl benzene,methylbutyl benzene PubChem CID: 17627 IUPAC Name: pentan-2-ylbenzene SMILES: CCCC(C)C1=CC=CC=C1

PubChem CID 17627
CAS 2719-52-0
Molecular Weight (g/mol) 148.25
MDL Number MFCD00027145
SMILES CCCC(C)C1=CC=CC=C1
Synonym 2-phenylpentane,sec-pentylbenzene,benzene, sec-pentyl,sec-amylbenzene,benzene, 1-methylbutyl,1-phenyl-1-methylbutane,s-amylbenzene,d-2-phenyl-pentane,sec-amyl benzene,methylbutyl benzene
IUPAC Name pentan-2-ylbenzene
InChI Key LTHAIAJHDPJXLG-UHFFFAOYNA-N
Molecular Formula C11H16
8

1,4-Di-n-butylbenzene, 97+%

CAS: 1571-86-4 Molecular Formula: C14H22 Molecular Weight (g/mol): 190.33 MDL Number: MFCD01076591 InChI Key: VGQOZYOOFXEGDA-UHFFFAOYSA-N Synonym: 1,4-di-n-butylbenzene,benzene, 1,4-dibutyl,p-dibutylbenzol,p-dibutylbenzene,acmc-209dfm,p-di-tert-butyl benzene PubChem CID: 519170 IUPAC Name: 1,4-dibutylbenzene SMILES: CCCCC1=CC=C(CCCC)C=C1

PubChem CID 519170
CAS 1571-86-4
Molecular Weight (g/mol) 190.33
MDL Number MFCD01076591
SMILES CCCCC1=CC=C(CCCC)C=C1
Synonym 1,4-di-n-butylbenzene,benzene, 1,4-dibutyl,p-dibutylbenzol,p-dibutylbenzene,acmc-209dfm,p-di-tert-butyl benzene
IUPAC Name 1,4-dibutylbenzene
InChI Key VGQOZYOOFXEGDA-UHFFFAOYSA-N
Molecular Formula C14H22
9

Tetraphenylmethane, 96%

CAS: 630-76-2 Molecular Formula: C25H20 Molecular Weight (g/mol): 320.435 MDL Number: MFCD00014428 InChI Key: PEQHIRFAKIASBK-UHFFFAOYSA-N Synonym: tetraphenylmethane,methane, tetraphenyl,tetraphenyl methane,benzene, 1,1',1,1'-methanetetrayltetrakis,triphenylmethyl benzene,benzene, 1,1',1,1'-methanethetrayltetrakis,acmc-20ajiz,pubchem10677 PubChem CID: 12424 IUPAC Name: tritylbenzene SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

PubChem CID 12424
CAS 630-76-2
Molecular Weight (g/mol) 320.435
MDL Number MFCD00014428
SMILES C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
Synonym tetraphenylmethane,methane, tetraphenyl,tetraphenyl methane,benzene, 1,1',1,1'-methanetetrayltetrakis,triphenylmethyl benzene,benzene, 1,1',1,1'-methanethetrayltetrakis,acmc-20ajiz,pubchem10677
IUPAC Name tritylbenzene
InChI Key PEQHIRFAKIASBK-UHFFFAOYSA-N
Molecular Formula C25H20
10

1,2,4-Trimethylbenzene, 98%

CAS: 95-63-6 Molecular Formula: C9H12 Molecular Weight (g/mol): 120.195 MDL Number: MFCD00008527 InChI Key: GWHJZXXIDMPWGX-UHFFFAOYSA-N Synonym: pseudocumene,pseudocumol,psi-cumene,as-trimethylbenzene,1,3,4-trimethylbenzene,benzene, 1,2,4-trimethyl,uns-trimethylbenzene,1,2,5-trimethylbenzene,asymmetrical trimethylbenzene,.psi.-cumene PubChem CID: 7247 ChEBI: CHEBI:34039 IUPAC Name: 1,2,4-trimethylbenzene SMILES: CC1=CC(=C(C=C1)C)C

PubChem CID 7247
CAS 95-63-6
Molecular Weight (g/mol) 120.195
ChEBI CHEBI:34039
MDL Number MFCD00008527
SMILES CC1=CC(=C(C=C1)C)C
Synonym pseudocumene,pseudocumol,psi-cumene,as-trimethylbenzene,1,3,4-trimethylbenzene,benzene, 1,2,4-trimethyl,uns-trimethylbenzene,1,2,5-trimethylbenzene,asymmetrical trimethylbenzene,.psi.-cumene
IUPAC Name 1,2,4-trimethylbenzene
InChI Key GWHJZXXIDMPWGX-UHFFFAOYSA-N
Molecular Formula C9H12
11

1,3-Diethylbenzene, 97+%

CAS: 141-93-5 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.222 MDL Number: MFCD00009260 InChI Key: AFZZYIJIWUTJFO-UHFFFAOYSA-N Synonym: m-diethylbenzene,benzene, 1,3-diethyl,benzene, m-diethyl,m-ethylethylbenzene,unii-zm2x7i1g8y,zm2x7i1g8y,ethylated benzene,benzene, ethylated,meta-diethylbenzene,polyethylated benzene PubChem CID: 8864 IUPAC Name: 1,3-diethylbenzene SMILES: CCC1=CC(=CC=C1)CC

PubChem CID 8864
CAS 141-93-5
Molecular Weight (g/mol) 134.222
MDL Number MFCD00009260
SMILES CCC1=CC(=CC=C1)CC
Synonym m-diethylbenzene,benzene, 1,3-diethyl,benzene, m-diethyl,m-ethylethylbenzene,unii-zm2x7i1g8y,zm2x7i1g8y,ethylated benzene,benzene, ethylated,meta-diethylbenzene,polyethylated benzene
IUPAC Name 1,3-diethylbenzene
InChI Key AFZZYIJIWUTJFO-UHFFFAOYSA-N
Molecular Formula C10H14
12

4-Methylbiphenyl, 98%

CAS: 644-08-6 Molecular Formula: C13H12 Molecular Weight (g/mol): 168.24 MDL Number: MFCD00008544 InChI Key: ZZLCFHIKESPLTH-UHFFFAOYSA-N Synonym: 4-methylbiphenyl,4-phenyltoluene,4-methyl-1,1'-biphenyl,p-methylbiphenyl,p-methyldiphenyl,4-methyldiphenyl,1,1'-biphenyl, 4-methyl,biphenyl, 4-methyl,p-phenyltoluene,4-methylphenyl benzene PubChem CID: 12566 SMILES: CC1=CC=C(C=C1)C1=CC=CC=C1

PubChem CID 12566
CAS 644-08-6
Molecular Weight (g/mol) 168.24
MDL Number MFCD00008544
SMILES CC1=CC=C(C=C1)C1=CC=CC=C1
Synonym 4-methylbiphenyl,4-phenyltoluene,4-methyl-1,1'-biphenyl,p-methylbiphenyl,p-methyldiphenyl,4-methyldiphenyl,1,1'-biphenyl, 4-methyl,biphenyl, 4-methyl,p-phenyltoluene,4-methylphenyl benzene
InChI Key ZZLCFHIKESPLTH-UHFFFAOYSA-N
Molecular Formula C13H12
13
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Hexamethylbenzene, 98+%

CAS: 87-85-4 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.27 MDL Number: MFCD00008523 InChI Key: YUWFEBAXEOLKSG-UHFFFAOYSA-N Synonym: hexamethylbenzene,mellitene,benzene, hexamethyl,hexamethylbenzol,hexamethyl benzene,unii-j8sd5741v8,1,2,3,4,5,6-hexamethyl-benzene,benzene, 1,2,3,4,5,6-hexamethyl,hexamethyl-benzene,hexamethylbenxene; PubChem CID: 6908 ChEBI: CHEBI:39001 IUPAC Name: 1,2,3,4,5,6-hexamethylbenzene SMILES: CC1=C(C(=C(C(=C1C)C)C)C)C

PubChem CID 6908
CAS 87-85-4
Molecular Weight (g/mol) 162.27
ChEBI CHEBI:39001
MDL Number MFCD00008523
SMILES CC1=C(C(=C(C(=C1C)C)C)C)C
Synonym hexamethylbenzene,mellitene,benzene, hexamethyl,hexamethylbenzol,hexamethyl benzene,unii-j8sd5741v8,1,2,3,4,5,6-hexamethyl-benzene,benzene, 1,2,3,4,5,6-hexamethyl,hexamethyl-benzene,hexamethylbenxene;
IUPAC Name 1,2,3,4,5,6-hexamethylbenzene
InChI Key YUWFEBAXEOLKSG-UHFFFAOYSA-N
Molecular Formula C12H18
14

Pentaphenylcyclopentadiene, 99%

CAS: 2519-10-0 Molecular Formula: C35H26 Molecular Weight (g/mol): 446.593 MDL Number: MFCD09909572 InChI Key: YGLVWOUNCXBPJF-UHFFFAOYSA-N PubChem CID: 635023 IUPAC Name: (2,3,4,5-tetraphenylcyclopenta-1,4-dien-1-yl)benzene SMILES: C1=CC=C(C=C1)C2C(=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

PubChem CID 635023
CAS 2519-10-0
Molecular Weight (g/mol) 446.593
MDL Number MFCD09909572
SMILES C1=CC=C(C=C1)C2C(=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6
IUPAC Name (2,3,4,5-tetraphenylcyclopenta-1,4-dien-1-yl)benzene
InChI Key YGLVWOUNCXBPJF-UHFFFAOYSA-N
Molecular Formula C35H26
15

2-Methylbiphenyl, 98%

CAS: 643-58-3 Molecular Formula: C13H12 Molecular Weight (g/mol): 168.239 MDL Number: MFCD00008517 InChI Key: ALLIZEAXNXSFGD-UHFFFAOYSA-N Synonym: 2-methylbiphenyl,2-methyl-1,1'-biphenyl,2-phenyltoluene,2-methyl biphenyl,o-phenyltoluene,o-methylbiphenyl,2-methyl-biphenyl,1,1'-biphenyl, 2-methyl,biphenyl, 2-methyl,unii-x937mq8s1t PubChem CID: 12563 IUPAC Name: 1-methyl-2-phenylbenzene SMILES: CC1=CC=CC=C1C2=CC=CC=C2

PubChem CID 12563
CAS 643-58-3
Molecular Weight (g/mol) 168.239
MDL Number MFCD00008517
SMILES CC1=CC=CC=C1C2=CC=CC=C2
Synonym 2-methylbiphenyl,2-methyl-1,1'-biphenyl,2-phenyltoluene,2-methyl biphenyl,o-phenyltoluene,o-methylbiphenyl,2-methyl-biphenyl,1,1'-biphenyl, 2-methyl,biphenyl, 2-methyl,unii-x937mq8s1t
IUPAC Name 1-methyl-2-phenylbenzene
InChI Key ALLIZEAXNXSFGD-UHFFFAOYSA-N
Molecular Formula C13H12