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Benzodioxanes

Aromatic organic heterocyclic compounds that consist of benzene fused with a dioxane ring; dioxane rings are six-membered heterocyclic compounds with two oxygen atoms, and are considered ethers.

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1

N,N’-Bis(1,4-benzodioxane-2-carbonyl)piperazine, TRC

CAS: 617677-53-9 Molecular Formula: C22 H22 N2 O6 Molecular Weight (g/mol): 410.42 Synonym: 1,4-Bis(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazine,Doxazosin Mesilate Imp. C (EP) IUPAC Name: [4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone SMILES: O=C(C1COc2ccccc2O1)N3CCN(CC3)C(=O)C4COc5ccccc5O4

CAS 617677-53-9
Molecular Weight (g/mol) 410.42
SMILES O=C(C1COc2ccccc2O1)N3CCN(CC3)C(=O)C4COc5ccccc5O4
Synonym 1,4-Bis(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazine,Doxazosin Mesilate Imp. C (EP)
IUPAC Name [4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone
Molecular Formula C22 H22 N2 O6
2

2,3-Dihydro-1,4-benzodioxine-5-carboxamide, 97%, Thermo Scientific™

CAS: 349550-81-8 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.175 MDL Number: MFCD03659722 InChI Key: OIYLTYTXMKZKCR-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzo b 1,4 dioxine-5-carboxamide,maybridge3_004369,2h,3h-benzo e 1,4-dioxane-5-carboxamide,1,4-benzodioxin-5-carboxamide,2,3-dihydro,5wy PubChem CID: 2779845 IUPAC Name: 2,3-dihydro-1,4-benzodioxine-5-carboxamide SMILES: C1COC2=C(C=CC=C2O1)C(=O)N

PubChem CID 2779845
CAS 349550-81-8
Molecular Weight (g/mol) 179.175
MDL Number MFCD03659722
SMILES C1COC2=C(C=CC=C2O1)C(=O)N
Synonym 2,3-dihydrobenzo b 1,4 dioxine-5-carboxamide,maybridge3_004369,2h,3h-benzo e 1,4-dioxane-5-carboxamide,1,4-benzodioxin-5-carboxamide,2,3-dihydro,5wy
IUPAC Name 2,3-dihydro-1,4-benzodioxine-5-carboxamide
InChI Key OIYLTYTXMKZKCR-UHFFFAOYSA-N
Molecular Formula C9H9NO3
4

2,3-Dihydro-1,4-benzodioxine-6-carbaldehyde 97%, Thermo Scientific™

CAS: 29668-44-8 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 InChI Key: CWKXDPPQCVWXAG-UHFFFAOYSA-N Synonym: 1,4-benzodioxan-6-carboxaldehyde,1,4-benzodioxan-6-carbaldehyde,2,3-dihydrobenzo b 1,4 dioxine-6-carbaldehyde,1,4-benzodioxane-6-carboxaldehyde,3,4-ethylenedioxybenzaldehyde,1,4-benzodioxin-6-carboxaldehyde, 2,3-dihydro,7-formyl-1,4-benzodioxane,1,4-benzodioxane-6-aldehyde,2,3-dihydro-1,4-benzodioxin-6-carbaldehyde,1,4-benzodioxane-6-carbaldehyde PubChem CID: 248127 IUPAC Name: 2,3-dihydro-1,4-benzodioxine-6-carbaldehyde SMILES: C1COC2=C(O1)C=CC(=C2)C=O

PubChem CID 248127
CAS 29668-44-8
Molecular Weight (g/mol) 164.16
SMILES C1COC2=C(O1)C=CC(=C2)C=O
Synonym 1,4-benzodioxan-6-carboxaldehyde,1,4-benzodioxan-6-carbaldehyde,2,3-dihydrobenzo b 1,4 dioxine-6-carbaldehyde,1,4-benzodioxane-6-carboxaldehyde,3,4-ethylenedioxybenzaldehyde,1,4-benzodioxin-6-carboxaldehyde, 2,3-dihydro,7-formyl-1,4-benzodioxane,1,4-benzodioxane-6-aldehyde,2,3-dihydro-1,4-benzodioxin-6-carbaldehyde,1,4-benzodioxane-6-carbaldehyde
IUPAC Name 2,3-dihydro-1,4-benzodioxine-6-carbaldehyde
InChI Key CWKXDPPQCVWXAG-UHFFFAOYSA-N
Molecular Formula C9H8O3
5

6-Iodo-1,4-benzodioxane, 95%, remainder mainly 5-isomer

CAS: 57744-67-9 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.05 MDL Number: MFCD00221460 InChI Key: HZTMYTXWFHBHDC-UHFFFAOYSA-N Synonym: 3,4-ethylenedioxyiodobenzene,6-iodo-2,3-dihydrobenzo b 1,4 dioxine,6-iodobenzodioxane,acmc-1azse,6-iodo-1,4-benzodioxane,6-iodo-2h,3h-benzo e 1,4-dioxin,2,3-dihydro-6-iodobenzo 1,4 dioxin,1,4-benzodioxin,2,3-dihydro-6-iodo PubChem CID: 2776176 IUPAC Name: 6-iodo-2,3-dihydro-1,4-benzodioxine SMILES: IC1=CC=C2OCCOC2=C1

PubChem CID 2776176
CAS 57744-67-9
Molecular Weight (g/mol) 262.05
MDL Number MFCD00221460
SMILES IC1=CC=C2OCCOC2=C1
Synonym 3,4-ethylenedioxyiodobenzene,6-iodo-2,3-dihydrobenzo b 1,4 dioxine,6-iodobenzodioxane,acmc-1azse,6-iodo-1,4-benzodioxane,6-iodo-2h,3h-benzo e 1,4-dioxin,2,3-dihydro-6-iodobenzo 1,4 dioxin,1,4-benzodioxin,2,3-dihydro-6-iodo
IUPAC Name 6-iodo-2,3-dihydro-1,4-benzodioxine
InChI Key HZTMYTXWFHBHDC-UHFFFAOYSA-N
Molecular Formula C8H7IO2
6

2,3-Dihydro-1,4-benzodioxin-5-ylmethylamine, 97%, Thermo Scientific™

CAS: 261633-71-0 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 InChI Key: OKRXRKUGZVMPKX-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzo b 1,4 dioxin-5-yl methanamine,c-2,3-dihydro-benzo 1,4 dioxin-5-yl-methylamine,1,4-benzodioxin-5-methanamine, 2,3-dihydro,2,3-dihydro-1,4-benzodioxin-5-ylmethylamine,5-aminomethyl-1,4-benzodioxane,1-2,3-dihydro-1,4-benzodioxin-5-yl methanamine,c-2,3-dihydrobenzo 1,4 dioxin-5-yl methylamine PubChem CID: 2795040 IUPAC Name: 2,3-dihydro-1,4-benzodioxin-5-ylmethanamine SMILES: C1COC2=C(C=CC=C2O1)CN

PubChem CID 2795040
CAS 261633-71-0
Molecular Weight (g/mol) 165.192
SMILES C1COC2=C(C=CC=C2O1)CN
Synonym 2,3-dihydrobenzo b 1,4 dioxin-5-yl methanamine,c-2,3-dihydro-benzo 1,4 dioxin-5-yl-methylamine,1,4-benzodioxin-5-methanamine, 2,3-dihydro,2,3-dihydro-1,4-benzodioxin-5-ylmethylamine,5-aminomethyl-1,4-benzodioxane,1-2,3-dihydro-1,4-benzodioxin-5-yl methanamine,c-2,3-dihydrobenzo 1,4 dioxin-5-yl methylamine
IUPAC Name 2,3-dihydro-1,4-benzodioxin-5-ylmethanamine
InChI Key OKRXRKUGZVMPKX-UHFFFAOYSA-N
Molecular Formula C9H11NO2
7

2-Hydroxymethyl-1,4-benzodioxane, 98%

CAS: 3663-82-9 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00006822 InChI Key: GWQOQQVKVOOHTI-UHFFFAOYSA-N Synonym: 2-hydroxymethyl-1,4-benzodioxane,2,3-dihydro-benzo 1,4 dioxin-2-yl-methanol,1,4-benzodioxan-2-methanol,2,3-dihydro-1,4-benzodioxin-2-ylmethanol,2,3-dihydrobenzo b 1,4 dioxin-2-yl methanol,1,4-benzodioxane-2-methanol,2-hydroxymethyl-1,4-benzodioxan,1,4-benzodioxin-2-methanol, 2,3-dihydro PubChem CID: 19314 IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethanol SMILES: C1C(OC2=CC=CC=C2O1)CO

PubChem CID 19314
CAS 3663-82-9
Molecular Weight (g/mol) 166.176
MDL Number MFCD00006822
SMILES C1C(OC2=CC=CC=C2O1)CO
Synonym 2-hydroxymethyl-1,4-benzodioxane,2,3-dihydro-benzo 1,4 dioxin-2-yl-methanol,1,4-benzodioxan-2-methanol,2,3-dihydro-1,4-benzodioxin-2-ylmethanol,2,3-dihydrobenzo b 1,4 dioxin-2-yl methanol,1,4-benzodioxane-2-methanol,2-hydroxymethyl-1,4-benzodioxan,1,4-benzodioxin-2-methanol, 2,3-dihydro
IUPAC Name 2,3-dihydro-1,4-benzodioxin-3-ylmethanol
InChI Key GWQOQQVKVOOHTI-UHFFFAOYSA-N
Molecular Formula C9H10O3
8

2,3-Dihydro-1,4-benzodioxine-6-carboxylic acid, 97%, Thermo Scientific™

CAS: 4442-54-0 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00463509 InChI Key: JWZQJTGQFHIRFQ-UHFFFAOYSA-N Synonym: 1,4-benzodioxane-6-carboxylic acid,2,3-dihydrobenzo b 1,4 dioxine-6-carboxylic acid,3,4-ethylenedioxy benzoic acid,2,3-dihydro-benzo 1,4 dioxine-6-carboxylic acid,1,4-benzodioxin-6-carboxylic acid, 2,3-dihydro,3,4-ethylenedioxybenzoic acid,1,4-benzodioxan-6-carboxylic acid,2,3-dihydro-1,4-benzodioxin-6-carboxylic acid,2,3-dihydro-1,4-benzodioxine-6-carboxylicacid,6-carboxy-2,3-dihydro-1,4-benzodioxine PubChem CID: 2758833 IUPAC Name: 2,3-dihydro-1,4-benzodioxine-6-carboxylic acid SMILES: C1COC2=C(O1)C=CC(=C2)C(=O)O

PubChem CID 2758833
CAS 4442-54-0
Molecular Weight (g/mol) 180.159
MDL Number MFCD00463509
SMILES C1COC2=C(O1)C=CC(=C2)C(=O)O
Synonym 1,4-benzodioxane-6-carboxylic acid,2,3-dihydrobenzo b 1,4 dioxine-6-carboxylic acid,3,4-ethylenedioxy benzoic acid,2,3-dihydro-benzo 1,4 dioxine-6-carboxylic acid,1,4-benzodioxin-6-carboxylic acid, 2,3-dihydro,3,4-ethylenedioxybenzoic acid,1,4-benzodioxan-6-carboxylic acid,2,3-dihydro-1,4-benzodioxin-6-carboxylic acid,2,3-dihydro-1,4-benzodioxine-6-carboxylicacid,6-carboxy-2,3-dihydro-1,4-benzodioxine
IUPAC Name 2,3-dihydro-1,4-benzodioxine-6-carboxylic acid
InChI Key JWZQJTGQFHIRFQ-UHFFFAOYSA-N
Molecular Formula C9H8O4
9

1,4-Benzodioxane, 98%

CAS: 493-09-4 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00006821 InChI Key: BNBQRQQYDMDJAH-UHFFFAOYSA-N Synonym: 1,4-benzodioxane,1,4-benzodioxan,2,3-dihydrobenzo b 1,4 dioxine,1,4-benzodioxin, 2,3-dihydro,pyrocatechol ethylene ether,1,2-ethylenedioxy benzene,benzodioxan,ethylene o-phenylene dioxide,1,2-ethylenedioxybenzene,1, 4-benzdioxan PubChem CID: 10301 IUPAC Name: 2,3-dihydro-1,4-benzodioxine SMILES: C1COC2=CC=CC=C2O1

PubChem CID 10301
CAS 493-09-4
Molecular Weight (g/mol) 136.15
MDL Number MFCD00006821
SMILES C1COC2=CC=CC=C2O1
Synonym 1,4-benzodioxane,1,4-benzodioxan,2,3-dihydrobenzo b 1,4 dioxine,1,4-benzodioxin, 2,3-dihydro,pyrocatechol ethylene ether,1,2-ethylenedioxy benzene,benzodioxan,ethylene o-phenylene dioxide,1,2-ethylenedioxybenzene,1, 4-benzdioxan
IUPAC Name 2,3-dihydro-1,4-benzodioxine
InChI Key BNBQRQQYDMDJAH-UHFFFAOYSA-N
Molecular Formula C8H8O2
11

2,3-Dihydro-1,4-benzodioxine-5-carbaldehyde, Thermo Scientific™

CAS: 29668-43-7 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00239451 InChI Key: BJXUCBAQZJITKD-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzo b 1,4 dioxine-5-carbaldehyde,2,3-dihydro-benzo 1,4 dioxine-5-carbaldehyde,1,4-benzodioxin-5-carboxaldehyde, 2,3-dihydro,2,3-dihydro-1,4-benzodioxine-5-carbaldehyd,2,3-dihydro-1,4-benzodioxin-5-carboxaldehyde,2,3-ethylenedioxybenzaldehyde,2,3-dihydrobenzodioxin-5-carboxaldehyde,1,4-benzodioxane-5-carboxaldehyde,2h,3h-benzo e 1,4-dioxin-5-carbaldehyde,2,3-dihydro-1,4-benzdioxin-5-carbaldehyde PubChem CID: 2795033 IUPAC Name: 2,3-dihydro-1,4-benzodioxine-5-carbaldehyde SMILES: O=CC1=C2OCCOC2=CC=C1

PubChem CID 2795033
CAS 29668-43-7
Molecular Weight (g/mol) 164.16
MDL Number MFCD00239451
SMILES O=CC1=C2OCCOC2=CC=C1
Synonym 2,3-dihydrobenzo b 1,4 dioxine-5-carbaldehyde,2,3-dihydro-benzo 1,4 dioxine-5-carbaldehyde,1,4-benzodioxin-5-carboxaldehyde, 2,3-dihydro,2,3-dihydro-1,4-benzodioxine-5-carbaldehyd,2,3-dihydro-1,4-benzodioxin-5-carboxaldehyde,2,3-ethylenedioxybenzaldehyde,2,3-dihydrobenzodioxin-5-carboxaldehyde,1,4-benzodioxane-5-carboxaldehyde,2h,3h-benzo e 1,4-dioxin-5-carbaldehyde,2,3-dihydro-1,4-benzdioxin-5-carbaldehyde
IUPAC Name 2,3-dihydro-1,4-benzodioxine-5-carbaldehyde
InChI Key BJXUCBAQZJITKD-UHFFFAOYSA-N
Molecular Formula C9H8O3
13

2,3-Dihydro-1,4-benzodioxin-6-ylmethanol, Thermo Scientific™

CAS: 39270-39-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD01317581 InChI Key: FFLHNBGNAWYMRH-UHFFFAOYSA-N Synonym: 2,3-dihydrobenzo b 1,4 dioxin-6-yl methanol,2,3-dihydro-1,4-benzodioxin-6-methanol,1,4-benzodioxin-6-methanol, 2,3-dihydro,1,4-benzodioxin-6-methanol,2,3-dihydro,2,3-dihydro-1,4-benzodioxin-6-yl methanol,1,4-benzodioxan-6-methanol,2,3-dihydro-1,4-benzodioxin-6-yl-methanol,2,3-dihydro-benzo 1,4 dioxin-6-yl methanol,2,3-dihydrobenzo 1,4 dioxin-6-yl-methanol,2,3-dihydro-benzo 1,4 dioxin-6-yl-methanol PubChem CID: 2776174 SMILES: OCC1=CC=C2OCCOC2=C1

PubChem CID 2776174
CAS 39270-39-8
Molecular Weight (g/mol) 166.18
MDL Number MFCD01317581
SMILES OCC1=CC=C2OCCOC2=C1
Synonym 2,3-dihydrobenzo b 1,4 dioxin-6-yl methanol,2,3-dihydro-1,4-benzodioxin-6-methanol,1,4-benzodioxin-6-methanol, 2,3-dihydro,1,4-benzodioxin-6-methanol,2,3-dihydro,2,3-dihydro-1,4-benzodioxin-6-yl methanol,1,4-benzodioxan-6-methanol,2,3-dihydro-1,4-benzodioxin-6-yl-methanol,2,3-dihydro-benzo 1,4 dioxin-6-yl methanol,2,3-dihydrobenzo 1,4 dioxin-6-yl-methanol,2,3-dihydro-benzo 1,4 dioxin-6-yl-methanol
InChI Key FFLHNBGNAWYMRH-UHFFFAOYSA-N
Molecular Formula C9H10O3
14

6-Bromo-1,4-benzodioxane, 98%

CAS: 52287-51-1 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00040750 InChI Key: LFCURAJBHDNUNG-UHFFFAOYSA-N Synonym: 6-bromo-1,4-benzodioxane,6-bromo-2,3-dihydrobenzo b 1,4 dioxine,3,4-ethylenedioxybromobenzene,6-bromo-2,3-dihydro-1,4-benzodioxin,1,4-benzodioxin, 6-bromo-2,3-dihydro,4-bromo-1,2-ethylenedioxybenzene,3,4-ethylendioxybromobenzene,6-bromo-2,3-dihydro-benzo 1,4 dioxine,pubchem3736,acmc-209kyk PubChem CID: 104141 IUPAC Name: 6-bromo-2,3-dihydro-1,4-benzodioxine SMILES: C1COC2=C(O1)C=CC(=C2)Br

PubChem CID 104141
CAS 52287-51-1
Molecular Weight (g/mol) 215.046
MDL Number MFCD00040750
SMILES C1COC2=C(O1)C=CC(=C2)Br
Synonym 6-bromo-1,4-benzodioxane,6-bromo-2,3-dihydrobenzo b 1,4 dioxine,3,4-ethylenedioxybromobenzene,6-bromo-2,3-dihydro-1,4-benzodioxin,1,4-benzodioxin, 6-bromo-2,3-dihydro,4-bromo-1,2-ethylenedioxybenzene,3,4-ethylendioxybromobenzene,6-bromo-2,3-dihydro-benzo 1,4 dioxine,pubchem3736,acmc-209kyk
IUPAC Name 6-bromo-2,3-dihydro-1,4-benzodioxine
InChI Key LFCURAJBHDNUNG-UHFFFAOYSA-N
Molecular Formula C8H7BrO2
15

5-Bromo-1,4-benzodioxane, 95%

CAS: 58328-39-5 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD03095029 InChI Key: NGOZRIZXELGVHK-UHFFFAOYSA-N Synonym: 5-bromo-1,4-benzodioxane,5-bromo-2,3-dihydro-1,4-benzodioxane,5-bromo-2,3-dihydrobenzo b 1,4 dioxine,acmc-209m3q,5-bromo-2,3-dihydrobenzo 1,4 dioxin,5-bromo-2,3-dihydro 1,4 benzodioxine,5-bromo-2,3-dihydro 1,4-benzodioxine,1,4-benzodioxin, 5-bromo-2,3-dihydro PubChem CID: 18787268 IUPAC Name: 5-bromo-2,3-dihydro-1,4-benzodioxine SMILES: C1COC2=C(O1)C=CC=C2Br

PubChem CID 18787268
CAS 58328-39-5
Molecular Weight (g/mol) 215.046
MDL Number MFCD03095029
SMILES C1COC2=C(O1)C=CC=C2Br
Synonym 5-bromo-1,4-benzodioxane,5-bromo-2,3-dihydro-1,4-benzodioxane,5-bromo-2,3-dihydrobenzo b 1,4 dioxine,acmc-209m3q,5-bromo-2,3-dihydrobenzo 1,4 dioxin,5-bromo-2,3-dihydro 1,4 benzodioxine,5-bromo-2,3-dihydro 1,4-benzodioxine,1,4-benzodioxin, 5-bromo-2,3-dihydro
IUPAC Name 5-bromo-2,3-dihydro-1,4-benzodioxine
InChI Key NGOZRIZXELGVHK-UHFFFAOYSA-N
Molecular Formula C8H7BrO2