
Carboxylic acids and derivatives















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Methyl propionate, 99%
CAS: 554-12-1 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.106 MDL Number: MFCD00009306 InChI Key: RJUFJBKOKNCXHH-UHFFFAOYSA-N Synonym: methyl propionate,propanoic acid, methyl ester,methyl propylate,methylpropionate,propionic acid, methyl ester,propionate de methyle,propanoic acid methyl ester,fema number 2742,propionic acid methyl ester,methyl propionate natural PubChem CID: 11124 IUPAC Name: methyl propanoate SMILES: CCC(=O)OC
PubChem CID | 11124 |
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CAS | 554-12-1 |
Molecular Weight (g/mol) | 88.106 |
MDL Number | MFCD00009306 |
SMILES | CCC(=O)OC |
Synonym | methyl propionate,propanoic acid, methyl ester,methyl propylate,methylpropionate,propionic acid, methyl ester,propionate de methyle,propanoic acid methyl ester,fema number 2742,propionic acid methyl ester,methyl propionate natural |
IUPAC Name | methyl propanoate |
InChI Key | RJUFJBKOKNCXHH-UHFFFAOYSA-N |
Molecular Formula | C4H8O2 |
Calcium propionate hydrate, 97%
CAS: 4075-81-4 Molecular Formula: C6H10CaO4 Molecular Weight (g/mol): 186.22 MDL Number: MFCD00167354 InChI Key: BCZXFFBUYPCTSJ-UHFFFAOYSA-L Synonym: calcium propionate,calcium dipropionate,calcium propanoate,mycoban,propanoic acid, calcium salt,bioban-c,caswell no. 151,propionic acid, calcium salt,unii-8ai80040kw,hsdb 907 PubChem CID: 19999 ChEBI: CHEBI:81716 IUPAC Name: calcium;propanoate SMILES: [Ca++].CCC([O-])=O.CCC([O-])=O
PubChem CID | 19999 |
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CAS | 4075-81-4 |
Molecular Weight (g/mol) | 186.22 |
ChEBI | CHEBI:81716 |
MDL Number | MFCD00167354 |
SMILES | [Ca++].CCC([O-])=O.CCC([O-])=O |
Synonym | calcium propionate,calcium dipropionate,calcium propanoate,mycoban,propanoic acid, calcium salt,bioban-c,caswell no. 151,propionic acid, calcium salt,unii-8ai80040kw,hsdb 907 |
IUPAC Name | calcium;propanoate |
InChI Key | BCZXFFBUYPCTSJ-UHFFFAOYSA-L |
Molecular Formula | C6H10CaO4 |
3-(4-Carboxyphenyl)propionic acid, 98%
CAS: 38628-51-2 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00016560 InChI Key: QSPCOYVUYYFWAU-UHFFFAOYSA-N Synonym: 4-2-carboxyethyl benzoic acid,3-4-carboxyphenyl propionic acid,3-4-carboxyphenyl propanoic acid,benzenepropanoic acid, 4-carboxy,pubchem19268,acmc-1ctf7,4-carboxyhydrocinnamic acid,4-carboxybenzenepropionic acid,4-2-carboxyethyl benzoicacid,carboxyphenylpropionicacid; 985 PubChem CID: 854054 IUPAC Name: 4-(2-carboxyethyl)benzoic acid SMILES: OC(=O)CCC1=CC=C(C=C1)C(O)=O
PubChem CID | 854054 |
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CAS | 38628-51-2 |
Molecular Weight (g/mol) | 194.19 |
MDL Number | MFCD00016560 |
SMILES | OC(=O)CCC1=CC=C(C=C1)C(O)=O |
Synonym | 4-2-carboxyethyl benzoic acid,3-4-carboxyphenyl propionic acid,3-4-carboxyphenyl propanoic acid,benzenepropanoic acid, 4-carboxy,pubchem19268,acmc-1ctf7,4-carboxyhydrocinnamic acid,4-carboxybenzenepropionic acid,4-2-carboxyethyl benzoicacid,carboxyphenylpropionicacid; 985 |
IUPAC Name | 4-(2-carboxyethyl)benzoic acid |
InChI Key | QSPCOYVUYYFWAU-UHFFFAOYSA-N |
Molecular Formula | C10H10O4 |
3-Cyclohexene-1-carboxylic acid, 98%
CAS: 4771-80-6 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.155 MDL Number: MFCD00013781 InChI Key: VUSWCWPCANWBFG-UHFFFAOYSA-N Synonym: 3-cyclohexene-1-carboxylic acid,3-cyclohexenecarboxylic acid,cyclohex-3-enecarboxylic acid,1,2,3,6-tetrahydrobenzoic acid,1-cyclohexene-4-carboxylic acid,delta3-cyclohexenylcarboxylic acid,kyselina 1,2,5,6-tetrahydrobenzoova,3-cyclohexene carboxylic acid,kyselina 1,2,5,6-tetrahydrobenzoova czech,.delta.3-cyclohexenecarboxylic acid PubChem CID: 20903 IUPAC Name: cyclohex-3-ene-1-carboxylic acid SMILES: C1CC(CC=C1)C(=O)O
PubChem CID | 20903 |
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CAS | 4771-80-6 |
Molecular Weight (g/mol) | 126.155 |
MDL Number | MFCD00013781 |
SMILES | C1CC(CC=C1)C(=O)O |
Synonym | 3-cyclohexene-1-carboxylic acid,3-cyclohexenecarboxylic acid,cyclohex-3-enecarboxylic acid,1,2,3,6-tetrahydrobenzoic acid,1-cyclohexene-4-carboxylic acid,delta3-cyclohexenylcarboxylic acid,kyselina 1,2,5,6-tetrahydrobenzoova,3-cyclohexene carboxylic acid,kyselina 1,2,5,6-tetrahydrobenzoova czech,.delta.3-cyclohexenecarboxylic acid |
IUPAC Name | cyclohex-3-ene-1-carboxylic acid |
InChI Key | VUSWCWPCANWBFG-UHFFFAOYSA-N |
Molecular Formula | C7H10O2 |
3-Nitrophthalimide, 98%
CAS: 603-62-3 Molecular Formula: C8H4N2O4 Molecular Weight (g/mol): 192.13 MDL Number: MFCD00041852 InChI Key: BONIIQYTWOPUQI-UHFFFAOYSA-N Synonym: 3-nitrophthalimide,4-nitroisoindoline-1,3-dione,phthalimide, 3-nitro,1h-isoindole-1,3 2h-dione, 4-nitro,nitrophthalimide,4-nitro-2,3-dihydro-1h-isoindole-1,3-dione,4-nitro-1h-isoindole-1,3 2h-dione,4-nitro-2h-benzo c azoline-1,3-dione,3-nitro-phthalimide,pubchem12007 PubChem CID: 11779 IUPAC Name: 4-nitroisoindole-1,3-dione SMILES: C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)NC2=O
PubChem CID | 11779 |
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CAS | 603-62-3 |
Molecular Weight (g/mol) | 192.13 |
MDL Number | MFCD00041852 |
SMILES | C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)NC2=O |
Synonym | 3-nitrophthalimide,4-nitroisoindoline-1,3-dione,phthalimide, 3-nitro,1h-isoindole-1,3 2h-dione, 4-nitro,nitrophthalimide,4-nitro-2,3-dihydro-1h-isoindole-1,3-dione,4-nitro-1h-isoindole-1,3 2h-dione,4-nitro-2h-benzo c azoline-1,3-dione,3-nitro-phthalimide,pubchem12007 |
IUPAC Name | 4-nitroisoindole-1,3-dione |
InChI Key | BONIIQYTWOPUQI-UHFFFAOYSA-N |
Molecular Formula | C8H4N2O4 |
Ethylenediaminetetraacetic acid manganese disodium salt hydrate
CAS: 15375-84-5 Molecular Formula: C10H12MnN2Na2O8 Molecular Weight (g/mol): 389.13 MDL Number: MFCD00661156 InChI Key: ZQHKAIDDHTYINE-UHFFFAOYSA-J Synonym: disodium manganese edta,edta disodium manganese salt,disodium manganese ethylenediaminetetraacetate,manganese disodium ethylene diamine tetraacetate,ethylenediaminetetraacetic acid, disodium manganese salt,disodium ethylenedinitrilo tetraacetato manganese,manganate 2-, disodium,glycine,n'-1,2-ethanediylbis n-carboxymethyl-, manganese disodium salt,manganate 2-,n'-1,2-ethanediylbis n-carboxymethyl glycinato 4--n,n',o,o',on,on'-, disodium, oc-6-21 PubChem CID: 5148022 IUPAC Name: 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid;manganese(2+) SMILES: [Na+].[Na+].[Mn++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O
PubChem CID | 5148022 |
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CAS | 15375-84-5 |
Molecular Weight (g/mol) | 389.13 |
MDL Number | MFCD00661156 |
SMILES | [Na+].[Na+].[Mn++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O |
Synonym | disodium manganese edta,edta disodium manganese salt,disodium manganese ethylenediaminetetraacetate,manganese disodium ethylene diamine tetraacetate,ethylenediaminetetraacetic acid, disodium manganese salt,disodium ethylenedinitrilo tetraacetato manganese,manganate 2-, disodium,glycine,n'-1,2-ethanediylbis n-carboxymethyl-, manganese disodium salt,manganate 2-,n'-1,2-ethanediylbis n-carboxymethyl glycinato 4--n,n',o,o',on,on'-, disodium, oc-6-21 |
IUPAC Name | 2-[2-[bis(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetic acid;manganese(2+) |
InChI Key | ZQHKAIDDHTYINE-UHFFFAOYSA-J |
Molecular Formula | C10H12MnN2Na2O8 |
Ethyl propionate
CAS: 105-37-3 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00009308 InChI Key: FKRCODPIKNYEAC-UHFFFAOYSA-N Synonym: ethyl propionate,propanoic acid, ethyl ester,propionic ester,propionic ether,propionic acid, ethyl ester,ethylpropionate,propionate d'ethyle,propanoic acid ethyl ester,ethyl n-propionate,propionic acid ethyl ester PubChem CID: 7749 ChEBI: CHEBI:41330 IUPAC Name: ethyl propanoate SMILES: CCC(=O)OCC
PubChem CID | 7749 |
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CAS | 105-37-3 |
Molecular Weight (g/mol) | 102.133 |
ChEBI | CHEBI:41330 |
MDL Number | MFCD00009308 |
SMILES | CCC(=O)OCC |
Synonym | ethyl propionate,propanoic acid, ethyl ester,propionic ester,propionic ether,propionic acid, ethyl ester,ethylpropionate,propionate d'ethyle,propanoic acid ethyl ester,ethyl n-propionate,propionic acid ethyl ester |
IUPAC Name | ethyl propanoate |
InChI Key | FKRCODPIKNYEAC-UHFFFAOYSA-N |
Molecular Formula | C5H10O2 |
Pentaerythritol triacrylate, stab. with 4-methoxyphenol
CAS: 3524-68-3 Molecular Formula: C14H18O7 Molecular Weight (g/mol): 298.291 MDL Number: MFCD00009607 InChI Key: HVVWZTWDBSEWIH-UHFFFAOYSA-N Synonym: pentaerythritol triacrylate,peta,pentaerythrityl triacrylate,gafgard 233,kayarad pet 30,sartomer sr 444,aronix m 305,setalux uv 2242,light acrylate pe 3a,p 300 acrylate PubChem CID: 19042 IUPAC Name: [2-(hydroxymethyl)-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate SMILES: C=CC(=O)OCC(CO)(COC(=O)C=C)COC(=O)C=C
PubChem CID | 19042 |
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CAS | 3524-68-3 |
Molecular Weight (g/mol) | 298.291 |
MDL Number | MFCD00009607 |
SMILES | C=CC(=O)OCC(CO)(COC(=O)C=C)COC(=O)C=C |
Synonym | pentaerythritol triacrylate,peta,pentaerythrityl triacrylate,gafgard 233,kayarad pet 30,sartomer sr 444,aronix m 305,setalux uv 2242,light acrylate pe 3a,p 300 acrylate |
IUPAC Name | [2-(hydroxymethyl)-3-prop-2-enoyloxy-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate |
InChI Key | HVVWZTWDBSEWIH-UHFFFAOYSA-N |
Molecular Formula | C14H18O7 |
Tetramethylammonium formate, 30% w/w aq. soln.
CAS: 59138-84-0 Molecular Formula: C5H13NO2 Molecular Weight (g/mol): 119.16 MDL Number: MFCD00054402 InChI Key: WWIYWFVQZQOECA-UHFFFAOYSA-M Synonym: tetramethylammonium formate,fibrogenina,forgenin,tonoformina,methanaminium, n,n,n-trimethyl-, formate,tetramethylazanium formate,n,n,n-trimethylmethanaminium formate,ammonium, tetramethyl-, formate,methanaminium, n,n,n-trimethyl-, formate 1:1,c4h12n.cho2 PubChem CID: 42961 IUPAC Name: tetramethylazanium;formate SMILES: [O-]C=O.C[N+](C)(C)C
PubChem CID | 42961 |
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CAS | 59138-84-0 |
Molecular Weight (g/mol) | 119.16 |
MDL Number | MFCD00054402 |
SMILES | [O-]C=O.C[N+](C)(C)C |
Synonym | tetramethylammonium formate,fibrogenina,forgenin,tonoformina,methanaminium, n,n,n-trimethyl-, formate,tetramethylazanium formate,n,n,n-trimethylmethanaminium formate,ammonium, tetramethyl-, formate,methanaminium, n,n,n-trimethyl-, formate 1:1,c4h12n.cho2 |
IUPAC Name | tetramethylazanium;formate |
InChI Key | WWIYWFVQZQOECA-UHFFFAOYSA-M |
Molecular Formula | C5H13NO2 |
Lithium isobutyrate, 98+%
CAS: 25179-23-1 Molecular Formula: C4H7LiO2 Molecular Weight (g/mol): 94.038 MDL Number: MFCD00210622 InChI Key: IIDVGIFOWJJSIJ-UHFFFAOYSA-M Synonym: lithium isobutyrate,lithium 2-methylpropanoate,acmc-1ccd2,isobutyric acid lithium salt,lithium 1+ isobutyrate,lithium 1+ ion isobutyrate PubChem CID: 23665557 IUPAC Name: lithium;2-methylpropanoate SMILES: [Li+].CC(C)C(=O)[O-]
PubChem CID | 23665557 |
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CAS | 25179-23-1 |
Molecular Weight (g/mol) | 94.038 |
MDL Number | MFCD00210622 |
SMILES | [Li+].CC(C)C(=O)[O-] |
Synonym | lithium isobutyrate,lithium 2-methylpropanoate,acmc-1ccd2,isobutyric acid lithium salt,lithium 1+ isobutyrate,lithium 1+ ion isobutyrate |
IUPAC Name | lithium;2-methylpropanoate |
InChI Key | IIDVGIFOWJJSIJ-UHFFFAOYSA-M |
Molecular Formula | C4H7LiO2 |
1-Methylindazole-3-carboxylic acid, 97%
CAS: 50890-83-0 Molecular Formula: C9H8N2O2 Molecular Weight (g/mol): 176.175 MDL Number: MFCD00272569 InChI Key: OVVDFORZEGKEJM-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazole-3-carboxylic acid,n-methyl-indazole-3-carboxylic acid,1-methyl-3-indazolecarboxylic acid,1h-indazole-3-carboxylic acid, 1-methyl,1-methyl-indazole-3-carboxylic acid,n-methylindazole-3-carboxylic acid,1-methylindozole-3-carboxylic acid,n-methyl-indozole-3-carboxylic acid,n-methyl-1h indazole-3-carboxylic acid,1-methyl-3-indazolecarboxylicacid PubChem CID: 689105 IUPAC Name: 1-methylindazole-3-carboxylic acid SMILES: CN1C2=CC=CC=C2C(=N1)C(=O)O
PubChem CID | 689105 |
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CAS | 50890-83-0 |
Molecular Weight (g/mol) | 176.175 |
MDL Number | MFCD00272569 |
SMILES | CN1C2=CC=CC=C2C(=N1)C(=O)O |
Synonym | 1-methyl-1h-indazole-3-carboxylic acid,n-methyl-indazole-3-carboxylic acid,1-methyl-3-indazolecarboxylic acid,1h-indazole-3-carboxylic acid, 1-methyl,1-methyl-indazole-3-carboxylic acid,n-methylindazole-3-carboxylic acid,1-methylindozole-3-carboxylic acid,n-methyl-indozole-3-carboxylic acid,n-methyl-1h indazole-3-carboxylic acid,1-methyl-3-indazolecarboxylicacid |
IUPAC Name | 1-methylindazole-3-carboxylic acid |
InChI Key | OVVDFORZEGKEJM-UHFFFAOYSA-N |
Molecular Formula | C9H8N2O2 |
trans-4-Methylcyclohexanecarboxylic acid, 98%
CAS: 13064-83-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00074943,MFCD00074909,MFCD20617670 InChI Key: QTDXSEZXAPHVBI-UHFFFAOYSA-N Synonym: trans-4-methylcyclohexanecarboxylic acid,4-methylcyclohexanecarboxylic acid,4-methyl-1-cyclohexanecarboxylic acid,cis-4-methylcyclohexanecarboxylic acid,unii-70f0i2amtv,unii-m7dsk28350,trans-4-methyl-1-cyclohexanecarboxylic acid,trans-4-methyl hexahydrobenzoic acid,trans-4-methylcyclohexane carboxylic acid,70f0i2amtv PubChem CID: 20330 IUPAC Name: 4-methylcyclohexane-1-carboxylic acid SMILES: CC1CCC(CC1)C(O)=O
PubChem CID | 20330 |
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CAS | 13064-83-0 |
Molecular Weight (g/mol) | 142.20 |
MDL Number | MFCD00074943,MFCD00074909,MFCD20617670 |
SMILES | CC1CCC(CC1)C(O)=O |
Synonym | trans-4-methylcyclohexanecarboxylic acid,4-methylcyclohexanecarboxylic acid,4-methyl-1-cyclohexanecarboxylic acid,cis-4-methylcyclohexanecarboxylic acid,unii-70f0i2amtv,unii-m7dsk28350,trans-4-methyl-1-cyclohexanecarboxylic acid,trans-4-methyl hexahydrobenzoic acid,trans-4-methylcyclohexane carboxylic acid,70f0i2amtv |
IUPAC Name | 4-methylcyclohexane-1-carboxylic acid |
InChI Key | QTDXSEZXAPHVBI-UHFFFAOYSA-N |
Molecular Formula | C8H14O2 |
2-Cyclopentene-1-acetic acid, tech. 90%, remainder mainly 3-cyclopentene-1-acetic acid
CAS: 13668-61-6 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.155 MDL Number: MFCD00001400 InChI Key: NNRZTJAACCRFRV-UHFFFAOYSA-N Synonym: 2-cyclopentene-1-acetic acid,2-cyclopent-2-en-1-yl acetic acid,cyclopent-2-enylacetic acid,2-cyclopenten-1-ylacetic acid,cyclopent-2-en-1-ylacetic acid,cyclopentene-3-acetic acid,2-cyclopentene-1-aceticacid,acmc-1c47k,2-cyclopent-2-enylacetic acid,cyclopent-2-ene-1-acetic acid PubChem CID: 96216 IUPAC Name: 2-cyclopent-2-en-1-ylacetic acid SMILES: C1CC(C=C1)CC(=O)O
PubChem CID | 96216 |
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CAS | 13668-61-6 |
Molecular Weight (g/mol) | 126.155 |
MDL Number | MFCD00001400 |
SMILES | C1CC(C=C1)CC(=O)O |
Synonym | 2-cyclopentene-1-acetic acid,2-cyclopent-2-en-1-yl acetic acid,cyclopent-2-enylacetic acid,2-cyclopenten-1-ylacetic acid,cyclopent-2-en-1-ylacetic acid,cyclopentene-3-acetic acid,2-cyclopentene-1-aceticacid,acmc-1c47k,2-cyclopent-2-enylacetic acid,cyclopent-2-ene-1-acetic acid |
IUPAC Name | 2-cyclopent-2-en-1-ylacetic acid |
InChI Key | NNRZTJAACCRFRV-UHFFFAOYSA-N |
Molecular Formula | C7H10O2 |
3-(3-Fluorophenyl)propionic acid, 97%
CAS: 458-45-7 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.167 MDL Number: MFCD01310821 InChI Key: UBLMRADOKLXLCD-UHFFFAOYSA-N PubChem CID: 2737489 IUPAC Name: 3-(3-fluorophenyl)propanoic acid SMILES: C1=CC(=CC(=C1)F)CCC(=O)O
PubChem CID | 2737489 |
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CAS | 458-45-7 |
Molecular Weight (g/mol) | 168.167 |
MDL Number | MFCD01310821 |
SMILES | C1=CC(=CC(=C1)F)CCC(=O)O |
IUPAC Name | 3-(3-fluorophenyl)propanoic acid |
InChI Key | UBLMRADOKLXLCD-UHFFFAOYSA-N |
Molecular Formula | C9H9FO2 |
Vinyl decanoate, 95%, stab.
CAS: 4704-31-8 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.306 MDL Number: MFCD00027349 InChI Key: CMDXMIHZUJPRHG-UHFFFAOYSA-N Synonym: vinyl decanoate,decanoic acid, vinyl ester,vinyl n-decanoate,unii-ff00i399li,decanoic acid, ethenyl ester,n-capric acid vinyl ester,decanoic acid vinyl,acmc-1aqz4,decanoic acid vinyl ester,capric acid vinyl ester = vinyl decenoate PubChem CID: 62140 IUPAC Name: ethenyl decanoate SMILES: CCCCCCCCCC(=O)OC=C
PubChem CID | 62140 |
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CAS | 4704-31-8 |
Molecular Weight (g/mol) | 198.306 |
MDL Number | MFCD00027349 |
SMILES | CCCCCCCCCC(=O)OC=C |
Synonym | vinyl decanoate,decanoic acid, vinyl ester,vinyl n-decanoate,unii-ff00i399li,decanoic acid, ethenyl ester,n-capric acid vinyl ester,decanoic acid vinyl,acmc-1aqz4,decanoic acid vinyl ester,capric acid vinyl ester = vinyl decenoate |
IUPAC Name | ethenyl decanoate |
InChI Key | CMDXMIHZUJPRHG-UHFFFAOYSA-N |
Molecular Formula | C12H22O2 |