Fatty acid esters

Fatty acid esters
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Methyl octanoate, 98+%
CAS: 111-11-5 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.241 MDL Number: MFCD00009551 InChI Key: JGHZJRVDZXSNKQ-UHFFFAOYSA-N Synonym: methyl caprylate,caprylic acid methyl ester,methyl n-octanoate,octanoic acid, methyl ester,uniphat a20,octanoic acid methyl ester,methyl octylate,methyl caprylate natural,unii-7mo740x6ql,fema no. 2728 PubChem CID: 8091 ChEBI: CHEBI:87432 IUPAC Name: methyl octanoate SMILES: CCCCCCCC(=O)OC
PubChem CID | 8091 |
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CAS | 111-11-5 |
Molecular Weight (g/mol) | 158.241 |
ChEBI | CHEBI:87432 |
MDL Number | MFCD00009551 |
SMILES | CCCCCCCC(=O)OC |
Synonym | methyl caprylate,caprylic acid methyl ester,methyl n-octanoate,octanoic acid, methyl ester,uniphat a20,octanoic acid methyl ester,methyl octylate,methyl caprylate natural,unii-7mo740x6ql,fema no. 2728 |
IUPAC Name | methyl octanoate |
InChI Key | JGHZJRVDZXSNKQ-UHFFFAOYSA-N |
Molecular Formula | C9H18O2 |
TraceCERTâ„¢ Methyl Palmitate, Certified Reference Material, MilliporeSigmaâ„¢ Supelcoâ„¢
This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.
Methyl behenate, 99%, analytical standard for GC
CAS: 929-77-1 Molecular Formula: C23H46O2 Molecular Weight (g/mol): 354.62 MDL Number: MFCD00009347 InChI Key: QSQLTHHMFHEFIY-UHFFFAOYSA-N Synonym: methyl behenate,docosanoic acid, methyl ester,behenic acid methyl ester,docosanoic acid methyl ester,behenic acid, methyl ester,unii-04kbo9r771,behenic methyl ester,kemester 9022,docosanoic acid methyl,acmc-209rjf PubChem CID: 13584 IUPAC Name: methyl docosanoate SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)OC
PubChem CID | 13584 |
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CAS | 929-77-1 |
Molecular Weight (g/mol) | 354.62 |
MDL Number | MFCD00009347 |
SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OC |
Synonym | methyl behenate,docosanoic acid, methyl ester,behenic acid methyl ester,docosanoic acid methyl ester,behenic acid, methyl ester,unii-04kbo9r771,behenic methyl ester,kemester 9022,docosanoic acid methyl,acmc-209rjf |
IUPAC Name | methyl docosanoate |
InChI Key | QSQLTHHMFHEFIY-UHFFFAOYSA-N |
Molecular Formula | C23H46O2 |
Methyl 3-oxo-pentanoate, 99+%
CAS: 30414-53-0 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.14 MDL Number: MFCD00011705 InChI Key: XJMIXEAZMCTAGH-UHFFFAOYSA-N Synonym: methyl 3-oxovalerate,methyl propionylacetate,methyl 3-oxo-pentanoate,pentanoic acid, 3-oxo-, methyl ester,methyl-3-oxo pentanoate,methyl 3-oxo-n-valerate,valeric acid, 3-oxo-, methyl ester,3-oxovaleric acid methyl ester,3-oxo-pentanoic acid methyl ester,3-keto-n-valeric acid methyl ester PubChem CID: 121699 IUPAC Name: methyl 3-oxopentanoate SMILES: CCC(=O)CC(=O)OC
PubChem CID | 121699 |
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CAS | 30414-53-0 |
Molecular Weight (g/mol) | 130.14 |
MDL Number | MFCD00011705 |
SMILES | CCC(=O)CC(=O)OC |
Synonym | methyl 3-oxovalerate,methyl propionylacetate,methyl 3-oxo-pentanoate,pentanoic acid, 3-oxo-, methyl ester,methyl-3-oxo pentanoate,methyl 3-oxo-n-valerate,valeric acid, 3-oxo-, methyl ester,3-oxovaleric acid methyl ester,3-oxo-pentanoic acid methyl ester,3-keto-n-valeric acid methyl ester |
IUPAC Name | methyl 3-oxopentanoate |
InChI Key | XJMIXEAZMCTAGH-UHFFFAOYSA-N |
Molecular Formula | C6H10O3 |
Methyl stearate, mixture of homologs
CAS: 112-61-8 Molecular Formula: C19H38O2 Molecular Weight (g/mol): 298.51 MDL Number: MFCD00009005 InChI Key: HPEUJPJOZXNMSJ-UHFFFAOYSA-N Synonym: methyl stearate,octadecanoic acid, methyl ester,stearic acid methyl ester,metholene 2218,kemester 9718,methyl n-octadecanoate,stearic acid, methyl ester,kemester 9018,emery 2218,n-octadecanoic acid methyl ester PubChem CID: 8201 ChEBI: CHEBI:69188 IUPAC Name: methyl octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)OC
PubChem CID | 8201 |
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CAS | 112-61-8 |
Molecular Weight (g/mol) | 298.51 |
ChEBI | CHEBI:69188 |
MDL Number | MFCD00009005 |
SMILES | CCCCCCCCCCCCCCCCCC(=O)OC |
Synonym | methyl stearate,octadecanoic acid, methyl ester,stearic acid methyl ester,metholene 2218,kemester 9718,methyl n-octadecanoate,stearic acid, methyl ester,kemester 9018,emery 2218,n-octadecanoic acid methyl ester |
IUPAC Name | methyl octadecanoate |
InChI Key | HPEUJPJOZXNMSJ-UHFFFAOYSA-N |
Molecular Formula | C19H38O2 |
Methyl linolenate, 99%
CAS: 301-00-8 Molecular Formula: C19H32O2 Molecular Weight (g/mol): 292.46 MDL Number: MFCD00135851 InChI Key: DVWSXZIHSUZZKJ-YSTUJMKBSA-N Synonym: methyl linolenate,linolenic acid methyl ester,methyl alpha-linolenate,linolenic acid, methyl ester,unii-0s1ns923k6,alpha-linolenic acid methyl ester,methyl all-cis-9,12,15-octadecatrienoate,methyl 9z,12z,15z-octadeca-9,12,15-trienoate,9,12,15-octadecatrienoic acid, methyl ester, z,z,z,methyl cis,cis,cis-octadec-9,12,15-trienoate PubChem CID: 5319706 IUPAC Name: methyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate SMILES: CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)OC
PubChem CID | 5319706 |
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CAS | 301-00-8 |
Molecular Weight (g/mol) | 292.46 |
MDL Number | MFCD00135851 |
SMILES | CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)OC |
Synonym | methyl linolenate,linolenic acid methyl ester,methyl alpha-linolenate,linolenic acid, methyl ester,unii-0s1ns923k6,alpha-linolenic acid methyl ester,methyl all-cis-9,12,15-octadecatrienoate,methyl 9z,12z,15z-octadeca-9,12,15-trienoate,9,12,15-octadecatrienoic acid, methyl ester, z,z,z,methyl cis,cis,cis-octadec-9,12,15-trienoate |
IUPAC Name | methyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate |
InChI Key | DVWSXZIHSUZZKJ-YSTUJMKBSA-N |
Molecular Formula | C19H32O2 |
Methyl caprate, 98+%
CAS: 110-42-9 Molecular Formula: C11H22O2 Molecular Weight (g/mol): 186.30 MDL Number: MFCD00009580 InChI Key: YRHYCMZPEVDGFQ-UHFFFAOYSA-N Synonym: methyl caprate,decanoic acid, methyl ester,methyl caprinate,capric acid methyl ester,decanoic acid methyl ester,methyl-n-caprate,uniphat a30,metholene 2095,methyl n-decanoate,methyl n-caprate PubChem CID: 8050 IUPAC Name: methyl decanoate SMILES: CCCCCCCCCC(=O)OC
PubChem CID | 8050 |
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CAS | 110-42-9 |
Molecular Weight (g/mol) | 186.30 |
MDL Number | MFCD00009580 |
SMILES | CCCCCCCCCC(=O)OC |
Synonym | methyl caprate,decanoic acid, methyl ester,methyl caprinate,capric acid methyl ester,decanoic acid methyl ester,methyl-n-caprate,uniphat a30,metholene 2095,methyl n-decanoate,methyl n-caprate |
IUPAC Name | methyl decanoate |
InChI Key | YRHYCMZPEVDGFQ-UHFFFAOYSA-N |
Molecular Formula | C11H22O2 |
Methyl 5-hexynoate, 95%
CAS: 77758-51-1 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.15 MDL Number: MFCD00671366 InChI Key: LZULAZTXJLWELL-UHFFFAOYSA-N Synonym: methyl 5-hexynoate,5-hexynoic acid, methyl ester,5-hexynoic acid methyl ester,hex-5-ynoic acid methyl ester,methyl 5-hexynoate #,hex-5-ynoic acid, methyl ester PubChem CID: 534077 IUPAC Name: methyl hex-5-ynoate SMILES: COC(=O)CCCC#C
PubChem CID | 534077 |
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CAS | 77758-51-1 |
Molecular Weight (g/mol) | 126.15 |
MDL Number | MFCD00671366 |
SMILES | COC(=O)CCCC#C |
Synonym | methyl 5-hexynoate,5-hexynoic acid, methyl ester,5-hexynoic acid methyl ester,hex-5-ynoic acid methyl ester,methyl 5-hexynoate #,hex-5-ynoic acid, methyl ester |
IUPAC Name | methyl hex-5-ynoate |
InChI Key | LZULAZTXJLWELL-UHFFFAOYSA-N |
Molecular Formula | C7H10O2 |
Methyl undecanoate, 99%
CAS: 1731-86-8 Molecular Formula: C12H24O2 Molecular Weight (g/mol): 200.322 MDL Number: MFCD00008957 InChI Key: XPQPWPZFBULGKT-UHFFFAOYSA-N Synonym: undecanoic acid methyl ester,undecanoic acid, methyl ester,methyl n-undecanoate,unii-k67yz97w6c,undecanoic acid methylester,n-undecanoic acid methyl ester,methyl undecanoate,acmc-209e5z,undecanoic acid, methylester,3-02-00-00858 beilstein handbook reference PubChem CID: 15607 ChEBI: CHEBI:87527 IUPAC Name: methyl undecanoate SMILES: CCCCCCCCCCC(=O)OC
PubChem CID | 15607 |
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CAS | 1731-86-8 |
Molecular Weight (g/mol) | 200.322 |
ChEBI | CHEBI:87527 |
MDL Number | MFCD00008957 |
SMILES | CCCCCCCCCCC(=O)OC |
Synonym | undecanoic acid methyl ester,undecanoic acid, methyl ester,methyl n-undecanoate,unii-k67yz97w6c,undecanoic acid methylester,n-undecanoic acid methyl ester,methyl undecanoate,acmc-209e5z,undecanoic acid, methylester,3-02-00-00858 beilstein handbook reference |
IUPAC Name | methyl undecanoate |
InChI Key | XPQPWPZFBULGKT-UHFFFAOYSA-N |
Molecular Formula | C12H24O2 |
Methyl 4-bromobutyrate, 97%
CAS: 4897-84-1 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.03 MDL Number: MFCD00041482 InChI Key: QAWFLJGZSZIZHO-UHFFFAOYSA-N Synonym: methyl 4-bromobutyrate,4-bromobutyric acid methyl ester,methyl-4-bromobutyrate,butanoic acid, 4-bromo-, methyl ester,methyl4-bromobutyrate,butyric acid, 4-bromo-, methyl ester,methyl gamma-bromobutyrate,acmc-1amn9,4-brombutyric acid methyl ester,4-bromobutyric acid methyl-ester PubChem CID: 107604 IUPAC Name: methyl 4-bromobutanoate SMILES: COC(=O)CCCBr
PubChem CID | 107604 |
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CAS | 4897-84-1 |
Molecular Weight (g/mol) | 181.03 |
MDL Number | MFCD00041482 |
SMILES | COC(=O)CCCBr |
Synonym | methyl 4-bromobutyrate,4-bromobutyric acid methyl ester,methyl-4-bromobutyrate,butanoic acid, 4-bromo-, methyl ester,methyl4-bromobutyrate,butyric acid, 4-bromo-, methyl ester,methyl gamma-bromobutyrate,acmc-1amn9,4-brombutyric acid methyl ester,4-bromobutyric acid methyl-ester |
IUPAC Name | methyl 4-bromobutanoate |
InChI Key | QAWFLJGZSZIZHO-UHFFFAOYSA-N |
Molecular Formula | C5H9BrO2 |
Methyl 7-phenylheptanoate, 98%
CAS: 101689-18-3 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.31 MDL Number: MFCD02093971 InChI Key: FZSNATXOGRAOIL-UHFFFAOYSA-N Synonym: acmc-20akft,benzeneheptanoic acid,methyl ester,7-phenylheptanoic acid methyl ester PubChem CID: 7010318 IUPAC Name: methyl 7-phenylheptanoate SMILES: COC(=O)CCCCCCC1=CC=CC=C1
PubChem CID | 7010318 |
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CAS | 101689-18-3 |
Molecular Weight (g/mol) | 220.31 |
MDL Number | MFCD02093971 |
SMILES | COC(=O)CCCCCCC1=CC=CC=C1 |
Synonym | acmc-20akft,benzeneheptanoic acid,methyl ester,7-phenylheptanoic acid methyl ester |
IUPAC Name | methyl 7-phenylheptanoate |
InChI Key | FZSNATXOGRAOIL-UHFFFAOYSA-N |
Molecular Formula | C14H20O2 |
Dimethyl azelate, 97%
CAS: 1732-10-1 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.28 MDL Number: MFCD00025898 InChI Key: DRUKNYVQGHETPO-UHFFFAOYSA-N Synonym: dimethyl azelate,nonanedioic acid, dimethyl ester,methyl azelate,azelaic acid dimethyl ester,azelaic acid, dimethyl ester,1,9-dimethyl nonanedioate,unii-29185k7oei,nonanedioic acid, 1,9-dimethyl ester,nonanedioic acid dimethyl ester,dimethyl nonane-1,9-dioate PubChem CID: 15612 SMILES: COC(=O)CCCCCCCC(=O)OC
PubChem CID | 15612 |
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CAS | 1732-10-1 |
Molecular Weight (g/mol) | 216.28 |
MDL Number | MFCD00025898 |
SMILES | COC(=O)CCCCCCCC(=O)OC |
Synonym | dimethyl azelate,nonanedioic acid, dimethyl ester,methyl azelate,azelaic acid dimethyl ester,azelaic acid, dimethyl ester,1,9-dimethyl nonanedioate,unii-29185k7oei,nonanedioic acid, 1,9-dimethyl ester,nonanedioic acid dimethyl ester,dimethyl nonane-1,9-dioate |
InChI Key | DRUKNYVQGHETPO-UHFFFAOYSA-N |
Molecular Formula | C11H20O4 |
Dimethyl itaconate, 97%
CAS: 617-52-7 Molecular Formula: C7H10O4 Molecular Weight (g/mol): 158.15 MDL Number: MFCD00008446 InChI Key: ZWWQRMFIZFPUAA-UHFFFAOYSA-N Synonym: dimethyl itaconate,dimethyl 2-methylenesuccinate,dimethylitaconate,itaconic acid dimethyl ester,itaconic acid, dimethyl ester,butanedioic acid, methylene-, dimethyl ester,1,4-dimethyl 2-methylidenebutanedioate,dimethyl methylenesuccinate,unii-11jib0yi93,succinic acid, methylene-, dimethyl ester PubChem CID: 69240 IUPAC Name: dimethyl 2-methylidenebutanedioate SMILES: COC(=O)CC(=C)C(=O)OC
PubChem CID | 69240 |
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CAS | 617-52-7 |
Molecular Weight (g/mol) | 158.15 |
MDL Number | MFCD00008446 |
SMILES | COC(=O)CC(=C)C(=O)OC |
Synonym | dimethyl itaconate,dimethyl 2-methylenesuccinate,dimethylitaconate,itaconic acid dimethyl ester,itaconic acid, dimethyl ester,butanedioic acid, methylene-, dimethyl ester,1,4-dimethyl 2-methylidenebutanedioate,dimethyl methylenesuccinate,unii-11jib0yi93,succinic acid, methylene-, dimethyl ester |
IUPAC Name | dimethyl 2-methylidenebutanedioate |
InChI Key | ZWWQRMFIZFPUAA-UHFFFAOYSA-N |
Molecular Formula | C7H10O4 |
Methyl isobutyrylacetate, 97+%
CAS: 42558-54-3 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00040499 InChI Key: HNNFDXWDCFCVDM-UHFFFAOYSA-N Synonym: methyl isobutyrylacetate,methyl 4-methyl-3-oxovalerate,4-methyl-3-oxovaleric acid methyl ester,iso-butyryl methyl acetate,methyl 4-methyl-3-oxo-pentanoate,methylisobutyrylacetate,acmc-209jq9,ksc237g2d,methyl 4-methyl-3oxopentanoate,methyl4-methyl-3-oxopentanoate PubChem CID: 2759969 IUPAC Name: methyl 4-methyl-3-oxopentanoate SMILES: CC(C)C(=O)CC(=O)OC
PubChem CID | 2759969 |
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CAS | 42558-54-3 |
Molecular Weight (g/mol) | 144.17 |
MDL Number | MFCD00040499 |
SMILES | CC(C)C(=O)CC(=O)OC |
Synonym | methyl isobutyrylacetate,methyl 4-methyl-3-oxovalerate,4-methyl-3-oxovaleric acid methyl ester,iso-butyryl methyl acetate,methyl 4-methyl-3-oxo-pentanoate,methylisobutyrylacetate,acmc-209jq9,ksc237g2d,methyl 4-methyl-3oxopentanoate,methyl4-methyl-3-oxopentanoate |
IUPAC Name | methyl 4-methyl-3-oxopentanoate |
InChI Key | HNNFDXWDCFCVDM-UHFFFAOYSA-N |
Molecular Formula | C7H12O3 |
Dimethyl sebacate, 97%
CAS: 106-79-6 Molecular Formula: C12H22O4 Molecular Weight (g/mol): 230.304 MDL Number: MFCD00008472 InChI Key: ALOUNLDAKADEEB-UHFFFAOYSA-N Synonym: dimethyl sebacate,methyl sebacate,decanedioic acid, dimethyl ester,sebacic acid dimethyl ester,sebacic acid, dimethyl ester,dimethyl octane-1,8-dicarboxylate,1,10-dimethyl decanedioate,decanedioic acid dimethyl ester,decanedioic acid, 1,10-dimethyl ester,dimethyl decane-1,10-dioate PubChem CID: 7829 IUPAC Name: dimethyl decanedioate SMILES: COC(=O)CCCCCCCCC(=O)OC
PubChem CID | 7829 |
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CAS | 106-79-6 |
Molecular Weight (g/mol) | 230.304 |
MDL Number | MFCD00008472 |
SMILES | COC(=O)CCCCCCCCC(=O)OC |
Synonym | dimethyl sebacate,methyl sebacate,decanedioic acid, dimethyl ester,sebacic acid dimethyl ester,sebacic acid, dimethyl ester,dimethyl octane-1,8-dicarboxylate,1,10-dimethyl decanedioate,decanedioic acid dimethyl ester,decanedioic acid, 1,10-dimethyl ester,dimethyl decane-1,10-dioate |
IUPAC Name | dimethyl decanedioate |
InChI Key | ALOUNLDAKADEEB-UHFFFAOYSA-N |
Molecular Formula | C12H22O4 |