Organic acids and derivatives
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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 |
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 |
2-Ethylbutyl Acetate 98.0+%, TCI America™
CAS: 10031-87-5 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00009343 InChI Key: HQLKZWRSOHTERR-UHFFFAOYSA-N Synonym: acetic acid, 2-ethylbutyl ester,2-ethyl butyl acetate,beta-ethylbutyl acetate,acetic acid 2-ethylbutyl ester,1-butanol, 2-ethyl-, acetate,fema no. 2425,2-ethylbutylacetat,2-ethylbutyl=acetate,acmc-2097ot,2-ethylbutyl acetate PubChem CID: 61448 IUPAC Name: 2-ethylbutyl acetate SMILES: CCC(CC)COC(=O)C
| PubChem CID | 61448 |
|---|---|
| CAS | 10031-87-5 |
| Molecular Weight (g/mol) | 144.214 |
| MDL Number | MFCD00009343 |
| SMILES | CCC(CC)COC(=O)C |
| Synonym | acetic acid, 2-ethylbutyl ester,2-ethyl butyl acetate,beta-ethylbutyl acetate,acetic acid 2-ethylbutyl ester,1-butanol, 2-ethyl-, acetate,fema no. 2425,2-ethylbutylacetat,2-ethylbutyl=acetate,acmc-2097ot,2-ethylbutyl acetate |
| IUPAC Name | 2-ethylbutyl acetate |
| InChI Key | HQLKZWRSOHTERR-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
2-Allyl-5,5-dimethyl-1,3,2-dioxaborinane (stabilized with Phenothiazine) 98.0+%, TCI America™
CAS: 911482-75-2 Molecular Formula: C8H15BO2 Molecular Weight (g/mol): 154.02 MDL Number: MFCD27966263 InChI Key: SBZNRMJWIVCYBF-UHFFFAOYSA-N PubChem CID: 11851265 IUPAC Name: 5,5-dimethyl-2-(prop-2-en-1-yl)-1,3,2-dioxaborinane SMILES: CC1(C)COB(CC=C)OC1
| PubChem CID | 11851265 |
|---|---|
| CAS | 911482-75-2 |
| Molecular Weight (g/mol) | 154.02 |
| MDL Number | MFCD27966263 |
| SMILES | CC1(C)COB(CC=C)OC1 |
| IUPAC Name | 5,5-dimethyl-2-(prop-2-en-1-yl)-1,3,2-dioxaborinane |
| InChI Key | SBZNRMJWIVCYBF-UHFFFAOYSA-N |
| Molecular Formula | C8H15BO2 |
Zaltoprofen 98.0+%, TCI America™
CAS: 74711-43-6 Molecular Formula: C17H14O3S Molecular Weight (g/mol): 298.356 MDL Number: MFCD00864323 InChI Key: MUXFZBHBYYYLTH-UHFFFAOYSA-N Synonym: 2-(10,11-Dihydro-10-oxodibenzo[b,f]thiepin-2-yl)propionic Acid PubChem CID: 5720 IUPAC Name: 2-(6-oxo-5H-benzo[b][1]benzothiepin-3-yl)propanoic acid SMILES: CC(C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2)C(=O)O
| PubChem CID | 5720 |
|---|---|
| CAS | 74711-43-6 |
| Molecular Weight (g/mol) | 298.356 |
| MDL Number | MFCD00864323 |
| SMILES | CC(C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2)C(=O)O |
| Synonym | 2-(10,11-Dihydro-10-oxodibenzo[b,f]thiepin-2-yl)propionic Acid |
| IUPAC Name | 2-(6-oxo-5H-benzo[b][1]benzothiepin-3-yl)propanoic acid |
| InChI Key | MUXFZBHBYYYLTH-UHFFFAOYSA-N |
| Molecular Formula | C17H14O3S |
Stearyl Gallate 97.0+%, TCI America™
CAS: 10361-12-3 Molecular Formula: C25H42O5 Molecular Weight (g/mol): 422.61 MDL Number: MFCD00016429 InChI Key: BRNPAEUKZMBRLQ-UHFFFAOYSA-N Synonym: Gallic Acid Stearyl Ester PubChem CID: 473591 IUPAC Name: octadecyl 3,4,5-trihydroxybenzoate SMILES: CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(O)=C(O)C(O)=C1
| PubChem CID | 473591 |
|---|---|
| CAS | 10361-12-3 |
| Molecular Weight (g/mol) | 422.61 |
| MDL Number | MFCD00016429 |
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(O)=C(O)C(O)=C1 |
| Synonym | Gallic Acid Stearyl Ester |
| IUPAC Name | octadecyl 3,4,5-trihydroxybenzoate |
| InChI Key | BRNPAEUKZMBRLQ-UHFFFAOYSA-N |
| Molecular Formula | C25H42O5 |
Guanine Hydrochloride Hydrate 98.0+%, TCI America™
CAS: 635-39-2 Molecular Formula: C5H6ClN5O Molecular Weight (g/mol): 187.59 MDL Number: MFCD00213670 InChI Key: IBAOFQIOOBQLHE-UHFFFAOYSA-N Synonym: guanine hydrochloride,guanine hcl,2-amino-1h-purin-6 7h-one hydrochloride,guanine, monohydrochloride,usaf s-1,guanine, hydrochloride,6h-purin-6-one, 2-amino-1,7-dihydro-, monohydrochloride,2-amino-9h-purin-6-ol hydrochloride 1:1,6h-purin-6-one, 2-amino-1,9-dihydro-, hydrochloride 1:1,2-amino-3,7-dihydropurin-6-one hydrochloride PubChem CID: 69459 IUPAC Name: 2-amino-6,7-dihydro-3H-purin-6-one hydrochloride SMILES: Cl.NC1=NC(=O)C2=C(N1)N=CN2
| PubChem CID | 69459 |
|---|---|
| CAS | 635-39-2 |
| Molecular Weight (g/mol) | 187.59 |
| MDL Number | MFCD00213670 |
| SMILES | Cl.NC1=NC(=O)C2=C(N1)N=CN2 |
| Synonym | guanine hydrochloride,guanine hcl,2-amino-1h-purin-6 7h-one hydrochloride,guanine, monohydrochloride,usaf s-1,guanine, hydrochloride,6h-purin-6-one, 2-amino-1,7-dihydro-, monohydrochloride,2-amino-9h-purin-6-ol hydrochloride 1:1,6h-purin-6-one, 2-amino-1,9-dihydro-, hydrochloride 1:1,2-amino-3,7-dihydropurin-6-one hydrochloride |
| IUPAC Name | 2-amino-6,7-dihydro-3H-purin-6-one hydrochloride |
| InChI Key | IBAOFQIOOBQLHE-UHFFFAOYSA-N |
| Molecular Formula | C5H6ClN5O |
Butyl Gallate 98.0+%, TCI America™
CAS: 1083-41-6 Molecular Formula: C11H14O5 Molecular Weight (g/mol): 226.228 MDL Number: MFCD00016432 InChI Key: XOPOEBVTQYAOSV-UHFFFAOYSA-N Synonym: Gallic Acid Butyl Ester PubChem CID: 14128 IUPAC Name: butyl 3,4,5-trihydroxybenzoate SMILES: CCCCOC(=O)C1=CC(=C(C(=C1)O)O)O
| PubChem CID | 14128 |
|---|---|
| CAS | 1083-41-6 |
| Molecular Weight (g/mol) | 226.228 |
| MDL Number | MFCD00016432 |
| SMILES | CCCCOC(=O)C1=CC(=C(C(=C1)O)O)O |
| Synonym | Gallic Acid Butyl Ester |
| IUPAC Name | butyl 3,4,5-trihydroxybenzoate |
| InChI Key | XOPOEBVTQYAOSV-UHFFFAOYSA-N |
| Molecular Formula | C11H14O5 |
Sodium 1-Hexadecanesulfonate, TCI America™
CAS: 15015-81-3 Molecular Formula: C16H33NaO3S Molecular Weight (g/mol): 328.487 MDL Number: MFCD00007528 InChI Key: PNGBYKXZVCIZRN-UHFFFAOYSA-M Synonym: sodium cetylsulfonate,sodium 1-hexadecanesulfonate,1-hexadecanesulfonic acid sodium salt,1-hexadecanesulfonic acid, sodium salt,sodium hexadecane-1-sulfonate,unii-sk4e885p15,sodium hexadecane-1-sulphonate,cetylsulfonic acid sodium salt,1-hexadecanesulfonic acid, sodium salt 1:1,hexadecylsulfonic acid sodium salt PubChem CID: 23665769 IUPAC Name: sodium;hexadecane-1-sulfonate SMILES: CCCCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+]
| PubChem CID | 23665769 |
|---|---|
| CAS | 15015-81-3 |
| Molecular Weight (g/mol) | 328.487 |
| MDL Number | MFCD00007528 |
| SMILES | CCCCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+] |
| Synonym | sodium cetylsulfonate,sodium 1-hexadecanesulfonate,1-hexadecanesulfonic acid sodium salt,1-hexadecanesulfonic acid, sodium salt,sodium hexadecane-1-sulfonate,unii-sk4e885p15,sodium hexadecane-1-sulphonate,cetylsulfonic acid sodium salt,1-hexadecanesulfonic acid, sodium salt 1:1,hexadecylsulfonic acid sodium salt |
| IUPAC Name | sodium;hexadecane-1-sulfonate |
| InChI Key | PNGBYKXZVCIZRN-UHFFFAOYSA-M |
| Molecular Formula | C16H33NaO3S |
4-Methyl-2(5H)-furanone 97.0+%, TCI America™
CAS: 6124-79-4 Molecular Formula: C5H6O2 Molecular Weight (g/mol): 98.10 MDL Number: MFCD00191546 InChI Key: ZZEYQBNQZKUWKY-UHFFFAOYSA-N Synonym: 4-Hydroxy-3-methyl-2-butenoic Acid gamma-Lactone PubChem CID: 145832 IUPAC Name: 4-methyl-2,5-dihydrofuran-2-one SMILES: CC1=CC(=O)OC1
| PubChem CID | 145832 |
|---|---|
| CAS | 6124-79-4 |
| Molecular Weight (g/mol) | 98.10 |
| MDL Number | MFCD00191546 |
| SMILES | CC1=CC(=O)OC1 |
| Synonym | 4-Hydroxy-3-methyl-2-butenoic Acid gamma-Lactone |
| IUPAC Name | 4-methyl-2,5-dihydrofuran-2-one |
| InChI Key | ZZEYQBNQZKUWKY-UHFFFAOYSA-N |
| Molecular Formula | C5H6O2 |
2-Sulfobenzoic Anhydride 97.0+%, TCI America™
CAS: 81-08-3 Molecular Formula: C7H4O4S Molecular Weight (g/mol): 184.165 MDL Number: MFCD00005879 InChI Key: NCYNKWQXFADUOZ-UHFFFAOYSA-N Synonym: 2-sulfobenzoic anhydride,2-sulfobenzoic acid cyclic anhydride,sulfobenzoic anhydride,o-sulfobenzoic acid anhydride,3h-2,1-benzoxathiol-3-one, 1,1-dioxide,3h-benzo c 1,2 oxathiol-3-one 1,1-dioxide,unii-0swh68iq5w,o-sulfobenzoic acid, cyclic anhydride,2,1-benzoxathiol-3-one-1,1-dioxide,0swh68iq5w PubChem CID: 65729 IUPAC Name: 1,1-dioxo-2,1$l^{6}-benzoxathiol-3-one SMILES: C1=CC=C2C(=C1)C(=O)OS2(=O)=O
| PubChem CID | 65729 |
|---|---|
| CAS | 81-08-3 |
| Molecular Weight (g/mol) | 184.165 |
| MDL Number | MFCD00005879 |
| SMILES | C1=CC=C2C(=C1)C(=O)OS2(=O)=O |
| Synonym | 2-sulfobenzoic anhydride,2-sulfobenzoic acid cyclic anhydride,sulfobenzoic anhydride,o-sulfobenzoic acid anhydride,3h-2,1-benzoxathiol-3-one, 1,1-dioxide,3h-benzo c 1,2 oxathiol-3-one 1,1-dioxide,unii-0swh68iq5w,o-sulfobenzoic acid, cyclic anhydride,2,1-benzoxathiol-3-one-1,1-dioxide,0swh68iq5w |
| IUPAC Name | 1,1-dioxo-2,1$l^{6}-benzoxathiol-3-one |
| InChI Key | NCYNKWQXFADUOZ-UHFFFAOYSA-N |
| Molecular Formula | C7H4O4S |
3-Methoxybenzohydrazide 98.0+%, TCI America™
CAS: 5785-06-8 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00007601 InChI Key: VMZSDAQEWPNOIB-UHFFFAOYSA-N Synonym: 3-methoxybenzhydrazide,m-anisic hydrazide,m-anisohydrazide,m-methoxy benzhydrazide,3-methoxybenzoic hydrazide,benzoylhydrazine, m-methoxy,3-methoxybenzenecarbohydrazide,3-methoxybenzene-1-carbohydrazide,benzoic acid, 3-methoxy-, hydrazide,m-anisoylhydrazine PubChem CID: 79848 IUPAC Name: 3-methoxybenzohydrazide SMILES: COC1=CC=CC(=C1)C(=O)NN
| PubChem CID | 79848 |
|---|---|
| CAS | 5785-06-8 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00007601 |
| SMILES | COC1=CC=CC(=C1)C(=O)NN |
| Synonym | 3-methoxybenzhydrazide,m-anisic hydrazide,m-anisohydrazide,m-methoxy benzhydrazide,3-methoxybenzoic hydrazide,benzoylhydrazine, m-methoxy,3-methoxybenzenecarbohydrazide,3-methoxybenzene-1-carbohydrazide,benzoic acid, 3-methoxy-, hydrazide,m-anisoylhydrazine |
| IUPAC Name | 3-methoxybenzohydrazide |
| InChI Key | VMZSDAQEWPNOIB-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O2 |
Sodium Sulfanilate Hydrate 98.0+%, TCI America™
CAS: 123333-70-0 Molecular Formula: C6H6NNaO3S Molecular Weight (g/mol): 195.17 MDL Number: MFCD00151043 InChI Key: KSVSZLXDULFGDQ-UHFFFAOYSA-M Synonym: sodium sulfanilate hydrate,sodium 4-aminobenzenesulfonate hydrate,sulfanilic acid sodium salt hydrate,4-aminobenzenesulfonic acid, sodium salt hydrate,sodium 4-aminobenzenesulfonate hydrate 1:1:x,acmc-209aoo,c6h6nso3.na.h2o,sodium4-aminobenzenesulfonatehydrate,p-anilinesulfonic acid sodium PubChem CID: 23672401 IUPAC Name: sodium 4-aminobenzene-1-sulfonate SMILES: [Na+].NC1=CC=C(C=C1)S([O-])(=O)=O
| PubChem CID | 23672401 |
|---|---|
| CAS | 123333-70-0 |
| Molecular Weight (g/mol) | 195.17 |
| MDL Number | MFCD00151043 |
| SMILES | [Na+].NC1=CC=C(C=C1)S([O-])(=O)=O |
| Synonym | sodium sulfanilate hydrate,sodium 4-aminobenzenesulfonate hydrate,sulfanilic acid sodium salt hydrate,4-aminobenzenesulfonic acid, sodium salt hydrate,sodium 4-aminobenzenesulfonate hydrate 1:1:x,acmc-209aoo,c6h6nso3.na.h2o,sodium4-aminobenzenesulfonatehydrate,p-anilinesulfonic acid sodium |
| IUPAC Name | sodium 4-aminobenzene-1-sulfonate |
| InChI Key | KSVSZLXDULFGDQ-UHFFFAOYSA-M |
| Molecular Formula | C6H6NNaO3S |
Sodium Sulfamate 98.0+%, TCI America™
CAS: 13845-18-6 Molecular Formula: H2NNaO3S Molecular Weight (g/mol): 119.07 MDL Number: MFCD00059940 InChI Key: QDWYPRSFEZRKDK-UHFFFAOYSA-M Synonym: Aminosulfonic Acid Sodium Salt, Sulfamic Acid Sodium Salt PubChem CID: 23700090 IUPAC Name: sodium;sulfamate SMILES: NS(=O)(=O)[O-].[Na+]
| PubChem CID | 23700090 |
|---|---|
| CAS | 13845-18-6 |
| Molecular Weight (g/mol) | 119.07 |
| MDL Number | MFCD00059940 |
| SMILES | NS(=O)(=O)[O-].[Na+] |
| Synonym | Aminosulfonic Acid Sodium Salt, Sulfamic Acid Sodium Salt |
| IUPAC Name | sodium;sulfamate |
| InChI Key | QDWYPRSFEZRKDK-UHFFFAOYSA-M |
| Molecular Formula | H2NNaO3S |
Disodium Succinate Hexahydrate 98.0+%, TCI America™
CAS: 6106-21-4 Molecular Formula: C4H16Na2O10 Molecular Weight (g/mol): 270.142 MDL Number: MFCD00002790 InChI Key: ZBTUYCUNQBRXOR-UHFFFAOYSA-L Synonym: disodium succinate hexahydrate,sodium succinate hexahydrate,unii-u16qod6c4e,butanedioic acid, disodium salt, hexahydrate,disodium butanedioate hexahydrate,u16qod6c4e,disodium hexahydrate succinate,sodium succinate dibasic hexahydrate,butanedioic acid disodium salt,succinic acid disodium salt hexahydrate PubChem CID: 3083938 ChEBI: CHEBI:63686 IUPAC Name: disodium;butanedioate;hexahydrate SMILES: C(CC(=O)[O-])C(=O)[O-].O.O.O.O.O.O.[Na+].[Na+]
| PubChem CID | 3083938 |
|---|---|
| CAS | 6106-21-4 |
| Molecular Weight (g/mol) | 270.142 |
| ChEBI | CHEBI:63686 |
| MDL Number | MFCD00002790 |
| SMILES | C(CC(=O)[O-])C(=O)[O-].O.O.O.O.O.O.[Na+].[Na+] |
| Synonym | disodium succinate hexahydrate,sodium succinate hexahydrate,unii-u16qod6c4e,butanedioic acid, disodium salt, hexahydrate,disodium butanedioate hexahydrate,u16qod6c4e,disodium hexahydrate succinate,sodium succinate dibasic hexahydrate,butanedioic acid disodium salt,succinic acid disodium salt hexahydrate |
| IUPAC Name | disodium;butanedioate;hexahydrate |
| InChI Key | ZBTUYCUNQBRXOR-UHFFFAOYSA-L |
| Molecular Formula | C4H16Na2O10 |