Organic acids and derivatives
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Indoxyl Acetate 98.0+%, TCI America™
CAS: 608-08-2 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.187 MDL Number: MFCD00014561 InChI Key: JBOPQACSHPPKEP-UHFFFAOYSA-N Synonym: 3-acetoxyindole,indoxyl acetate,3-indoxyl acetate,indoxyl-o-acetate,3-indolyl acetate,indole, 3-acetato,indoxylacetate,1h-indol-3-ol, 3-acetate,1h-indol-3-ol, acetate ester,acetic acid, 3-indolyl ester PubChem CID: 11841 IUPAC Name: 1H-indol-3-yl acetate SMILES: CC(=O)OC1=CNC2=CC=CC=C21
| PubChem CID | 11841 |
|---|---|
| CAS | 608-08-2 |
| Molecular Weight (g/mol) | 175.187 |
| MDL Number | MFCD00014561 |
| SMILES | CC(=O)OC1=CNC2=CC=CC=C21 |
| Synonym | 3-acetoxyindole,indoxyl acetate,3-indoxyl acetate,indoxyl-o-acetate,3-indolyl acetate,indole, 3-acetato,indoxylacetate,1h-indol-3-ol, 3-acetate,1h-indol-3-ol, acetate ester,acetic acid, 3-indolyl ester |
| IUPAC Name | 1H-indol-3-yl acetate |
| InChI Key | JBOPQACSHPPKEP-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO2 |
Allyl Acetate 97.0+%, TCI America™
CAS: 591-87-7 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.117 MDL Number: MFCD00008721 InChI Key: FWZUNOYOVVKUNF-UHFFFAOYSA-N Synonym: allyl acetate,3-acetoxypropene,acetic acid, 2-propenyl ester,2-propenyl acetate,2-propenyl ethanoate,3-acetoxy-1-propene,allylacetate,acetic acid, allyl ester,2-propenyl methanoate,unii-e4u5e5990i PubChem CID: 11584 IUPAC Name: prop-2-enyl acetate SMILES: CC(=O)OCC=C
| PubChem CID | 11584 |
|---|---|
| CAS | 591-87-7 |
| Molecular Weight (g/mol) | 100.117 |
| MDL Number | MFCD00008721 |
| SMILES | CC(=O)OCC=C |
| Synonym | allyl acetate,3-acetoxypropene,acetic acid, 2-propenyl ester,2-propenyl acetate,2-propenyl ethanoate,3-acetoxy-1-propene,allylacetate,acetic acid, allyl ester,2-propenyl methanoate,unii-e4u5e5990i |
| IUPAC Name | prop-2-enyl acetate |
| InChI Key | FWZUNOYOVVKUNF-UHFFFAOYSA-N |
| Molecular Formula | C5H8O2 |
Benzyl Acetate 99.0+%, TCI America™
CAS: 140-11-4 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00008712 InChI Key: QUKGYYKBILRGFE-UHFFFAOYSA-N Synonym: acetic acid benzyl ester,benzyl ethanoate,acetic acid, phenylmethyl ester,phenylmethyl acetate,acetic acid, benzyl ester,alpha-acetoxytoluene,phenylmethyl ethanoate,acetoxymethyl benzene,benzylester kyseliny octove,caswell no. 081ea PubChem CID: 8785 ChEBI: CHEBI:52051 IUPAC Name: benzyl acetate SMILES: CC(=O)OCC1=CC=CC=C1
| PubChem CID | 8785 |
|---|---|
| CAS | 140-11-4 |
| Molecular Weight (g/mol) | 150.177 |
| ChEBI | CHEBI:52051 |
| MDL Number | MFCD00008712 |
| SMILES | CC(=O)OCC1=CC=CC=C1 |
| Synonym | acetic acid benzyl ester,benzyl ethanoate,acetic acid, phenylmethyl ester,phenylmethyl acetate,acetic acid, benzyl ester,alpha-acetoxytoluene,phenylmethyl ethanoate,acetoxymethyl benzene,benzylester kyseliny octove,caswell no. 081ea |
| IUPAC Name | benzyl acetate |
| InChI Key | QUKGYYKBILRGFE-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Butyl Acetate 99.0+%, TCI America™
CAS: 123-86-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009445 InChI Key: DKPFZGUDAPQIHT-UHFFFAOYSA-N Synonym: n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle PubChem CID: 31272 ChEBI: CHEBI:31328 IUPAC Name: butyl acetate SMILES: CCCCOC(C)=O
| PubChem CID | 31272 |
|---|---|
| CAS | 123-86-4 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:31328 |
| MDL Number | MFCD00009445 |
| SMILES | CCCCOC(C)=O |
| Synonym | n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle |
| IUPAC Name | butyl acetate |
| InChI Key | DKPFZGUDAPQIHT-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
2-Methylbutyl Acetate 98.0+%, TCI America™
CAS: 624-41-9 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00040494 InChI Key: XHIUFYZDQBSEMF-UHFFFAOYSA-N Synonym: Acetic Acid 2-Methylbutyl Ester PubChem CID: 12209 ChEBI: CHEBI:50585 IUPAC Name: 2-methylbutyl acetate SMILES: CCC(C)COC(=O)C
| PubChem CID | 12209 |
|---|---|
| CAS | 624-41-9 |
| Molecular Weight (g/mol) | 130.187 |
| ChEBI | CHEBI:50585 |
| MDL Number | MFCD00040494 |
| SMILES | CCC(C)COC(=O)C |
| Synonym | Acetic Acid 2-Methylbutyl Ester |
| IUPAC Name | 2-methylbutyl acetate |
| InChI Key | XHIUFYZDQBSEMF-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
6,11-Dihydrodibenzo[b,e]thiepin-11-one 98.0+%, TCI America™
CAS: 1531-77-7 Molecular Formula: C14H10OS Molecular Weight (g/mol): 226.293 MDL Number: MFCD02093738 InChI Key: JGJDEWXZEIHBNW-UHFFFAOYSA-N Synonym: dibenzo b,e thiepin-11 6h-one,6,11-dihydrodibenzo b,e thiepin-11-one,dibenz b,e thiepin-11 6h-one,6h-benzo c 1 benzothiepin-11-one,1-oxo-6,11-dihydrodibenzo b,e thiepin,dothiepinone,9-thiatricyclo 9.4.0.0 3 ,? pentadeca-1 15 ,3,5,7,11,13-hexaen-2-one,acmc-1buub PubChem CID: 73741 IUPAC Name: 6H-benzo[c][1]benzothiepin-11-one SMILES: C1C2=CC=CC=C2C(=O)C3=CC=CC=C3S1
| PubChem CID | 73741 |
|---|---|
| CAS | 1531-77-7 |
| Molecular Weight (g/mol) | 226.293 |
| MDL Number | MFCD02093738 |
| SMILES | C1C2=CC=CC=C2C(=O)C3=CC=CC=C3S1 |
| Synonym | dibenzo b,e thiepin-11 6h-one,6,11-dihydrodibenzo b,e thiepin-11-one,dibenz b,e thiepin-11 6h-one,6h-benzo c 1 benzothiepin-11-one,1-oxo-6,11-dihydrodibenzo b,e thiepin,dothiepinone,9-thiatricyclo 9.4.0.0 3 ,? pentadeca-1 15 ,3,5,7,11,13-hexaen-2-one,acmc-1buub |
| IUPAC Name | 6H-benzo[c][1]benzothiepin-11-one |
| InChI Key | JGJDEWXZEIHBNW-UHFFFAOYSA-N |
| Molecular Formula | C14H10OS |
Mesotartaric Acid Monohydrate 90.0+%, TCI America™
CAS: 5990-63-6 Molecular Formula: C4H8O7 Molecular Weight (g/mol): 168.101 MDL Number: MFCD00063641 InChI Key: UUDLQDCYDSATCH-NUGIMEKKSA-N Synonym: meso-Tartaric Acid PubChem CID: 16218804 IUPAC Name: (2R,3S)-2,3-dihydroxybutanedioic acid;hydrate SMILES: C(C(C(=O)O)O)(C(=O)O)O.O
| PubChem CID | 16218804 |
|---|---|
| CAS | 5990-63-6 |
| Molecular Weight (g/mol) | 168.101 |
| MDL Number | MFCD00063641 |
| SMILES | C(C(C(=O)O)O)(C(=O)O)O.O |
| Synonym | meso-Tartaric Acid |
| IUPAC Name | (2R,3S)-2,3-dihydroxybutanedioic acid;hydrate |
| InChI Key | UUDLQDCYDSATCH-NUGIMEKKSA-N |
| Molecular Formula | C4H8O7 |
5-Butylpyridine-2-carboxylic Acid 98.0+%, TCI America™
CAS: 536-69-6 Molecular Formula: C10H13NO2 Molecular Weight (g/mol): 179.219 MDL Number: MFCD00006298 InChI Key: DGMPVYSXXIOGJY-UHFFFAOYSA-N Synonym: fusaric acid,5-butylpicolinic acid,fusarinic acid,2-pyridinecarboxylic acid, 5-butyl,5-butyl-2-pyridinecarboxylic acid,picolinic acid, 5-butyl,5-n-butylpyridine-2-carboxylic acid,unii-jwj963070n,5-butylpyridine-3-carboxylic acid,5-butyl-pyridine-2-carboxylic acid PubChem CID: 3442 ChEBI: CHEBI:5199 IUPAC Name: 5-butylpyridine-2-carboxylic acid SMILES: CCCCC1=CN=C(C=C1)C(=O)O
| PubChem CID | 3442 |
|---|---|
| CAS | 536-69-6 |
| Molecular Weight (g/mol) | 179.219 |
| ChEBI | CHEBI:5199 |
| MDL Number | MFCD00006298 |
| SMILES | CCCCC1=CN=C(C=C1)C(=O)O |
| Synonym | fusaric acid,5-butylpicolinic acid,fusarinic acid,2-pyridinecarboxylic acid, 5-butyl,5-butyl-2-pyridinecarboxylic acid,picolinic acid, 5-butyl,5-n-butylpyridine-2-carboxylic acid,unii-jwj963070n,5-butylpyridine-3-carboxylic acid,5-butyl-pyridine-2-carboxylic acid |
| IUPAC Name | 5-butylpyridine-2-carboxylic acid |
| InChI Key | DGMPVYSXXIOGJY-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO2 |
2-Ethyl-4-hydroxy-5-methyl-3(2H)-furanone 97.0+%, TCI America™
CAS: 27538-10-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.15 MDL Number: MFCD00191360 InChI Key: GWCRPYGYVRXVLI-UHFFFAOYNA-N PubChem CID: 33931 IUPAC Name: 2-ethyl-4-hydroxy-5-methyl-2,3-dihydrofuran-3-one SMILES: CCC1OC(C)=C(O)C1=O
| PubChem CID | 33931 |
|---|---|
| CAS | 27538-10-9 |
| Molecular Weight (g/mol) | 142.15 |
| MDL Number | MFCD00191360 |
| SMILES | CCC1OC(C)=C(O)C1=O |
| IUPAC Name | 2-ethyl-4-hydroxy-5-methyl-2,3-dihydrofuran-3-one |
| InChI Key | GWCRPYGYVRXVLI-UHFFFAOYNA-N |
| Molecular Formula | C7H10O3 |
Ethyl 3-Cyclopentene-1-carboxylate 97.0+%, TCI America™
CAS: 21622-01-5 Molecular Formula: C8H12O2 Molecular Weight (g/mol): 140.182 MDL Number: MFCD06410819 InChI Key: CTLAIKSGNQPPLO-UHFFFAOYSA-N Synonym: 3-Cyclopentene-1-carboxylic Acid Ethyl Ester PubChem CID: 5314991 IUPAC Name: ethyl cyclopent-3-ene-1-carboxylate SMILES: CCOC(=O)C1CC=CC1
| PubChem CID | 5314991 |
|---|---|
| CAS | 21622-01-5 |
| Molecular Weight (g/mol) | 140.182 |
| MDL Number | MFCD06410819 |
| SMILES | CCOC(=O)C1CC=CC1 |
| Synonym | 3-Cyclopentene-1-carboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl cyclopent-3-ene-1-carboxylate |
| InChI Key | CTLAIKSGNQPPLO-UHFFFAOYSA-N |
| Molecular Formula | C8H12O2 |
Propyl Formate 95.0+%, TCI America™
CAS: 110-74-7 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.106 MDL Number: MFCD00003295 InChI Key: KFNNIILCVOLYIR-UHFFFAOYSA-N Synonym: formic acid, propyl ester,n-propyl formate,propyl methanoate,formiate de propyle,formic acid propyl ester,propylester kyseliny mravenci,unii-wo1arv6gtw,formiate de propyle french,fema no. 2943,wo1arv6gtw PubChem CID: 8073 IUPAC Name: propyl formate SMILES: CCCOC=O
| PubChem CID | 8073 |
|---|---|
| CAS | 110-74-7 |
| Molecular Weight (g/mol) | 88.106 |
| MDL Number | MFCD00003295 |
| SMILES | CCCOC=O |
| Synonym | formic acid, propyl ester,n-propyl formate,propyl methanoate,formiate de propyle,formic acid propyl ester,propylester kyseliny mravenci,unii-wo1arv6gtw,formiate de propyle french,fema no. 2943,wo1arv6gtw |
| IUPAC Name | propyl formate |
| InChI Key | KFNNIILCVOLYIR-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2 |
Ethyl 10-Undecenoate 97.0+%, TCI America™
CAS: 692-86-4 Molecular Formula: C13H24O2 Molecular Weight (g/mol): 212.333 MDL Number: MFCD00009220 InChI Key: FXNFFCMITPHEIT-UHFFFAOYSA-N Synonym: 10-Undecenoic Acid Ethyl Ester PubChem CID: 12729 IUPAC Name: ethyl undec-10-enoate SMILES: CCOC(=O)CCCCCCCCC=C
| PubChem CID | 12729 |
|---|---|
| CAS | 692-86-4 |
| Molecular Weight (g/mol) | 212.333 |
| MDL Number | MFCD00009220 |
| SMILES | CCOC(=O)CCCCCCCCC=C |
| Synonym | 10-Undecenoic Acid Ethyl Ester |
| IUPAC Name | ethyl undec-10-enoate |
| InChI Key | FXNFFCMITPHEIT-UHFFFAOYSA-N |
| Molecular Formula | C13H24O2 |
Cyclohexyl Acetate 99.0+%, TCI America™
CAS: 622-45-7 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00003850 InChI Key: YYLLIJHXUHJATK-UHFFFAOYSA-N Synonym: acetic acid, cyclohexyl ester,hexalin acetate,cyclohexanyl acetate,cyclohexanol, acetate,cyclohexanolazetat,adronal acetate,acetic acid cyclohexyl ester,cyclohexane acetate,cyclohexylester kyseliny octove,unii-ul0rs4h1ue PubChem CID: 12146 ChEBI: CHEBI:31447 IUPAC Name: cyclohexyl acetate SMILES: CC(=O)OC1CCCCC1
| PubChem CID | 12146 |
|---|---|
| CAS | 622-45-7 |
| Molecular Weight (g/mol) | 142.198 |
| ChEBI | CHEBI:31447 |
| MDL Number | MFCD00003850 |
| SMILES | CC(=O)OC1CCCCC1 |
| Synonym | acetic acid, cyclohexyl ester,hexalin acetate,cyclohexanyl acetate,cyclohexanol, acetate,cyclohexanolazetat,adronal acetate,acetic acid cyclohexyl ester,cyclohexane acetate,cyclohexylester kyseliny octove,unii-ul0rs4h1ue |
| IUPAC Name | cyclohexyl acetate |
| InChI Key | YYLLIJHXUHJATK-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
4,4'-Biphthalic Anhydride (purified by sublimation) 98.0+%, TCI America™
CAS: 2420-87-3 Molecular Formula: C16H6O6 Molecular Weight (g/mol): 294.218 MDL Number: MFCD00039140 InChI Key: WKDNYTOXBCRNPV-UHFFFAOYSA-N Synonym: Diphenyl-3,3′C,4,4′C-tetracarboxylic Dianhydride PubChem CID: 75494 IUPAC Name: 5-(1,3-dioxo-2-benzofuran-5-yl)-2-benzofuran-1,3-dione SMILES: C1=CC2=C(C=C1C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O
| PubChem CID | 75494 |
|---|---|
| CAS | 2420-87-3 |
| Molecular Weight (g/mol) | 294.218 |
| MDL Number | MFCD00039140 |
| SMILES | C1=CC2=C(C=C1C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O |
| Synonym | Diphenyl-3,3′C,4,4′C-tetracarboxylic Dianhydride |
| IUPAC Name | 5-(1,3-dioxo-2-benzofuran-5-yl)-2-benzofuran-1,3-dione |
| InChI Key | WKDNYTOXBCRNPV-UHFFFAOYSA-N |
| Molecular Formula | C16H6O6 |
2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl 2,2,2-Trichloroacetimidate 98.0+%, TCI America™
CAS: 92052-29-4 Molecular Formula: C16H20Cl3NO10 Molecular Weight (g/mol): 492.683 InChI Key: IBUZGVQIKARDAF-RGDJUOJXSA-N PubChem CID: 11038322 IUPAC Name: [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(C(O1)OC(=N)C(Cl)(Cl)Cl)OC(=O)C)OC(=O)C)OC(=O)C
| PubChem CID | 11038322 |
|---|---|
| CAS | 92052-29-4 |
| Molecular Weight (g/mol) | 492.683 |
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC(=N)C(Cl)(Cl)Cl)OC(=O)C)OC(=O)C)OC(=O)C |
| IUPAC Name | [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate |
| InChI Key | IBUZGVQIKARDAF-RGDJUOJXSA-N |
| Molecular Formula | C16H20Cl3NO10 |