Fatty acid esters

The combination of a fatty acid with an alcohol; when the alcohol component is glycerol, the fatty acid esters produced can be monoglycerides, diglycerides, or triglycerides.

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Methyl octanoate, 99%

CAS: 111-11-5 Molecular Formula: C₉H₁₈O₂ Molecular Weight (g/mol): 158.24 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

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PubChem CID	8091
CAS	111-11-5
Molecular Weight (g/mol)	158.24
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

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Methyl hexanoate, 99%

CAS: 106-70-7 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00009510 InChI Key: NUKZAGXMHTUAFE-UHFFFAOYSA-N Synonym: methyl caproate,hexanoic acid methyl ester,hexanoic acid, methyl ester,methyl hexoate,methyl capronate,methyl n-hexanoate,methyl hexylate,caproic acid methyl ester,methyl caproate natural,methyl n-hexoate PubChem CID: 7824 ChEBI: CHEBI:77322 IUPAC Name: methyl hexanoate SMILES: CCCCCC(=O)OC

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PubChem CID	7824
CAS	106-70-7
Molecular Weight (g/mol)	130.19
ChEBI	CHEBI:77322
MDL Number	MFCD00009510
SMILES	CCCCCC(=O)OC
Synonym	methyl caproate,hexanoic acid methyl ester,hexanoic acid, methyl ester,methyl hexoate,methyl capronate,methyl n-hexanoate,methyl hexylate,caproic acid methyl ester,methyl caproate natural,methyl n-hexoate
IUPAC Name	methyl hexanoate
InChI Key	NUKZAGXMHTUAFE-UHFFFAOYSA-N
Molecular Formula	C7H14O2

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Methyl acetoacetate, 99+%

CAS: 105-45-3 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.12 MDL Number: MFCD00008784 InChI Key: WRQNANDWMGAFTP-UHFFFAOYSA-N Synonym: methyl acetoacetate,acetoacetic acid methyl ester,methylacetoacetate,methyl 3-oxobutyrate,butanoic acid, 3-oxo-, methyl ester,methyl acetylacetate,methyl acetylacetonate,3-oxobutanoic acid methyl ester,acetoacetic methyl ester,acetoacetic acid, methyl ester PubChem CID: 7757 IUPAC Name: methyl 3-oxobutanoate SMILES: COC(=O)CC(C)=O

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PubChem CID	7757
CAS	105-45-3
Molecular Weight (g/mol)	116.12
MDL Number	MFCD00008784
SMILES	COC(=O)CC(C)=O
Synonym	methyl acetoacetate,acetoacetic acid methyl ester,methylacetoacetate,methyl 3-oxobutyrate,butanoic acid, 3-oxo-, methyl ester,methyl acetylacetate,methyl acetylacetonate,3-oxobutanoic acid methyl ester,acetoacetic methyl ester,acetoacetic acid, methyl ester
IUPAC Name	methyl 3-oxobutanoate
InChI Key	WRQNANDWMGAFTP-UHFFFAOYSA-N
Molecular Formula	C5H8O3

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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

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PubChem CID	7010318
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

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Methyl linoleate, 95%

CAS: 112-63-0 Molecular Formula: C19H34O2 Molecular Weight (g/mol): 294.479 MDL Number: MFCD00009534 InChI Key: WTTJVINHCBCLGX-NQLNTKRDSA-N Synonym: methyl linoleate,linoleic acid methyl ester,methyl lineoleate,methyl 9z,12z-octadeca-9,12-dienoate,methyl octadecadienoate,methyl 9-cis,12-cis-octadecadienoate,linoleic acid,methyl ester,linoleic acid, methyl ester,methyl linoleate, native,9,12-octadecadienoic acid z,z-, methyl ester PubChem CID: 5284421 ChEBI: CHEBI:69080 IUPAC Name: methyl (9Z,12Z)-octadeca-9,12-dienoate SMILES: CCCCCC=CCC=CCCCCCCCC(=O)OC

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PubChem CID	5284421
CAS	112-63-0
Molecular Weight (g/mol)	294.479
ChEBI	CHEBI:69080
MDL Number	MFCD00009534
SMILES	CCCCCC=CCC=CCCCCCCCC(=O)OC
Synonym	methyl linoleate,linoleic acid methyl ester,methyl lineoleate,methyl 9z,12z-octadeca-9,12-dienoate,methyl octadecadienoate,methyl 9-cis,12-cis-octadecadienoate,linoleic acid,methyl ester,linoleic acid, methyl ester,methyl linoleate, native,9,12-octadecadienoic acid z,z-, methyl ester
IUPAC Name	methyl (9Z,12Z)-octadeca-9,12-dienoate
InChI Key	WTTJVINHCBCLGX-NQLNTKRDSA-N
Molecular Formula	C19H34O2

Methyl levulinate, 99+%

CAS: 624-45-3 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD00017499 InChI Key: UAGJVSRUFNSIHR-UHFFFAOYSA-N Synonym: methyl levulinate,methyllevulinate,levulinic acid methyl ester,pentanoic acid, 4-oxo-, methyl ester,methyl 4-oxovalerate,levulinic acid, methyl ester,4-oxovaleric acid methyl ester,4-oxo-pentanoic acid methyl ester,methyl levulate,me ester PubChem CID: 69354 IUPAC Name: methyl 4-oxopentanoate SMILES: CC(=O)CCC(=O)OC

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PubChem CID	69354
CAS	624-45-3
Molecular Weight (g/mol)	130.143
MDL Number	MFCD00017499
SMILES	CC(=O)CCC(=O)OC
Synonym	methyl levulinate,methyllevulinate,levulinic acid methyl ester,pentanoic acid, 4-oxo-, methyl ester,methyl 4-oxovalerate,levulinic acid, methyl ester,4-oxovaleric acid methyl ester,4-oxo-pentanoic acid methyl ester,methyl levulate,me ester
IUPAC Name	methyl 4-oxopentanoate
InChI Key	UAGJVSRUFNSIHR-UHFFFAOYSA-N
Molecular Formula	C6H10O3

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Methyl dodecanoate, 99%

CAS: 111-82-0 Molecular Formula: C13H26O2 Molecular Weight (g/mol): 214.349 MDL Number: MFCD00008966 InChI Key: UQDUPQYQJKYHQI-UHFFFAOYSA-N Synonym: methyl laurate,lauric acid methyl ester,dodecanoic acid, methyl ester,methyl laurinate,methyl dodecylate,methyl n-dodecanoate,uniphat a40,metholene 2296,lauric acid, methyl ester,stepan c40 PubChem CID: 8139 ChEBI: CHEBI:87494 IUPAC Name: methyl dodecanoate SMILES: CCCCCCCCCCCC(=O)OC

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PubChem CID	8139
CAS	111-82-0
Molecular Weight (g/mol)	214.349
ChEBI	CHEBI:87494
MDL Number	MFCD00008966
SMILES	CCCCCCCCCCCC(=O)OC
Synonym	methyl laurate,lauric acid methyl ester,dodecanoic acid, methyl ester,methyl laurinate,methyl dodecylate,methyl n-dodecanoate,uniphat a40,metholene 2296,lauric acid, methyl ester,stepan c40
IUPAC Name	methyl dodecanoate
InChI Key	UQDUPQYQJKYHQI-UHFFFAOYSA-N
Molecular Formula	C13H26O2

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Dimethyl adipate, 99+%

CAS: 627-93-0 Molecular Formula: C₈H₁₄O₄ Molecular Weight (g/mol): 174.2 MDL Number: MFCD00008469 InChI Key: UDSFAEKRVUSQDD-UHFFFAOYSA-N Synonym: dimethyl adipate,dimethyladipate,adipic acid dimethyl ester,hexanedioic acid, dimethyl ester,adipic acid, dimethyl ester,1,6-dimethylhexanedioate,methyl adipate van,1,6-dimethyl hexanedioate,dbe 6,unii-by71rx0r62 PubChem CID: 12329 ChEBI: CHEBI:34715 IUPAC Name: dimethyl hexanedioate SMILES: COC(=O)CCCCC(=O)OC

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PubChem CID	12329
CAS	627-93-0
Molecular Weight (g/mol)	174.2
ChEBI	CHEBI:34715
MDL Number	MFCD00008469
SMILES	COC(=O)CCCCC(=O)OC
Synonym	dimethyl adipate,dimethyladipate,adipic acid dimethyl ester,hexanedioic acid, dimethyl ester,adipic acid, dimethyl ester,1,6-dimethylhexanedioate,methyl adipate van,1,6-dimethyl hexanedioate,dbe 6,unii-by71rx0r62
IUPAC Name	dimethyl hexanedioate
InChI Key	UDSFAEKRVUSQDD-UHFFFAOYSA-N
Molecular Formula	C₈H₁₄O₄

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Methyl nervonate, 99%, analytical standard for GC

CAS: 2733-88-2 Molecular Formula: C₂₅H₄₈O₂ Molecular Weight (g/mol): 380.65 InChI Key: AINIZSBLAFHZCP-KHPPLWFESA-N Synonym: nervonic acid methyl ester,methyl nervonate,methyl z-tetracos-15-enoate,methyl cis-15-tetracosenoate,selacholeic acid methyl ester,15-tetracosenoic acid, methyl ester, z,methyl nervonate c24:1,z-methyl tetracos-15-enoate,methyl 15z tetracos-15-enoate,methyl 15z-15-tetracosenoate # PubChem CID: 5364841 IUPAC Name: methyl (Z)-tetracos-15-enoate SMILES: CCCCCCCCC=CCCCCCCCCCCCCCC(=O)OC

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PubChem CID	5364841
CAS	2733-88-2
Molecular Weight (g/mol)	380.65
SMILES	CCCCCCCCC=CCCCCCCCCCCCCCC(=O)OC
Synonym	nervonic acid methyl ester,methyl nervonate,methyl z-tetracos-15-enoate,methyl cis-15-tetracosenoate,selacholeic acid methyl ester,15-tetracosenoic acid, methyl ester, z,methyl nervonate c24:1,z-methyl tetracos-15-enoate,methyl 15z tetracos-15-enoate,methyl 15z-15-tetracosenoate #
IUPAC Name	methyl (Z)-tetracos-15-enoate
InChI Key	AINIZSBLAFHZCP-KHPPLWFESA-N
Molecular Formula	C₂₅H₄₈O₂

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

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PubChem CID	13584
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

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Methyl 3-hexenoate, 95+%, predominantly trans, Thermo Scientific™

CAS: 2396-78-3 Molecular Formula: C₇H₁₂O₂ Molecular Weight (g/mol): 128.17 MDL Number: MFCD00672771 InChI Key: XEAIHUDTEINXFG-SNAWJCMRSA-N Synonym: 3-hexenoic acid, methyl ester,methyl 3-hexenoate,methyl trans-3-hexenoate,methyl e-hex-3-enoate,honeyflor,3-hexenoic acid, methyl ester, e,unii-7ip0t834pb,methyl hex-3-enoate,methyl e-3-hexenoate,methyl trans 3 hexenoate PubChem CID: 5362782 IUPAC Name: methyl (E)-hex-3-enoate SMILES: CCC=CCC(=O)OC

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PubChem CID	5362782
CAS	2396-78-3
Molecular Weight (g/mol)	128.17
MDL Number	MFCD00672771
SMILES	CCC=CCC(=O)OC
Synonym	3-hexenoic acid, methyl ester,methyl 3-hexenoate,methyl trans-3-hexenoate,methyl e-hex-3-enoate,honeyflor,3-hexenoic acid, methyl ester, e,unii-7ip0t834pb,methyl hex-3-enoate,methyl e-3-hexenoate,methyl trans 3 hexenoate
IUPAC Name	methyl (E)-hex-3-enoate
InChI Key	XEAIHUDTEINXFG-SNAWJCMRSA-N
Molecular Formula	C₇H₁₂O₂

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Methyl 5-chloro-5-oxovalerate, 97%

CAS: 1501-26-4 Molecular Formula: C6H9ClO3 Molecular Weight (g/mol): 164.59 MDL Number: MFCD00000756 InChI Key: JCAZSWWHFJVFPP-UHFFFAOYSA-N Synonym: methyl 4-chloroformyl butyrate,methyl 5-chloro-5-oxovalerate,methyl 4-chloroformylbutyrate,methyl5-chloro-5-oxopentanoate,5-chloro-5-oxopentanoic acid methyl ester,methyl glutaryl chloride,pentanoic acid, 5-chloro-5-oxo-, methyl ester,4-chlorocarbonyl-butyric acid methyl ester,zlchem 559,pubchem14033 PubChem CID: 73916 IUPAC Name: methyl 5-chloro-5-oxopentanoate SMILES: COC(=O)CCCC(Cl)=O

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PubChem CID	73916
CAS	1501-26-4
Molecular Weight (g/mol)	164.59
MDL Number	MFCD00000756
SMILES	COC(=O)CCCC(Cl)=O
Synonym	methyl 4-chloroformyl butyrate,methyl 5-chloro-5-oxovalerate,methyl 4-chloroformylbutyrate,methyl5-chloro-5-oxopentanoate,5-chloro-5-oxopentanoic acid methyl ester,methyl glutaryl chloride,pentanoic acid, 5-chloro-5-oxo-, methyl ester,4-chlorocarbonyl-butyric acid methyl ester,zlchem 559,pubchem14033
IUPAC Name	methyl 5-chloro-5-oxopentanoate
InChI Key	JCAZSWWHFJVFPP-UHFFFAOYSA-N
Molecular Formula	C6H9ClO3

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Methyl pivaloylacetate, 98%

CAS: 55107-14-7 Molecular Formula: C₈H₁₄O₃ Molecular Weight (g/mol): 158.2 InChI Key: XTXCFTMJPRXBBC-UHFFFAOYSA-N Synonym: methyl pivaloylacetate,methyl 4,4-dimethyl-3-oxovalerate,methyl 4,4,4-trimethylacetoacetate,pentanoic acid, 4,4-dimethyl-3-oxo-, methyl ester,pivaloylacetic acid methyl ester,unii-99cq34ta4y,methyl 4,4,4-trimethyl-3-oxobutanoate,4,4-dimethyl-3-oxovaleric acid methyl ester,benzyl s---lactate,acmc-209ll2 PubChem CID: 99597 IUPAC Name: methyl 4,4-dimethyl-3-oxopentanoate SMILES: CC(C)(C)C(=O)CC(=O)OC

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PubChem CID	99597
CAS	55107-14-7
Molecular Weight (g/mol)	158.2
SMILES	CC(C)(C)C(=O)CC(=O)OC
Synonym	methyl pivaloylacetate,methyl 4,4-dimethyl-3-oxovalerate,methyl 4,4,4-trimethylacetoacetate,pentanoic acid, 4,4-dimethyl-3-oxo-, methyl ester,pivaloylacetic acid methyl ester,unii-99cq34ta4y,methyl 4,4,4-trimethyl-3-oxobutanoate,4,4-dimethyl-3-oxovaleric acid methyl ester,benzyl s---lactate,acmc-209ll2
IUPAC Name	methyl 4,4-dimethyl-3-oxopentanoate
InChI Key	XTXCFTMJPRXBBC-UHFFFAOYSA-N
Molecular Formula	C₈H₁₄O₃

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Methyl nonanoate, 95%

CAS: 1731-84-6 Molecular Formula: C₁₀H₂₀O₂ Molecular Weight (g/mol): 172.27 MDL Number: MFCD00009569 InChI Key: IJXHLVMUNBOGRR-UHFFFAOYSA-N Synonym: methyl pelargonate,pelargonic acid methyl ester,methyl nonylate,nonanoic acid, methyl ester,methyl n-nonanoate,nonanoic acid methyl ester,unii-7xkd6qoh68,fema no. 2724,methyl ester nonanoic acid,7xkd6qoh68 PubChem CID: 15606 ChEBI: CHEBI:44499 IUPAC Name: methyl nonanoate SMILES: CCCCCCCCC(=O)OC

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PubChem CID	15606
CAS	1731-84-6
Molecular Weight (g/mol)	172.27
ChEBI	CHEBI:44499
MDL Number	MFCD00009569
SMILES	CCCCCCCCC(=O)OC
Synonym	methyl pelargonate,pelargonic acid methyl ester,methyl nonylate,nonanoic acid, methyl ester,methyl n-nonanoate,nonanoic acid methyl ester,unii-7xkd6qoh68,fema no. 2724,methyl ester nonanoic acid,7xkd6qoh68
IUPAC Name	methyl nonanoate
InChI Key	IJXHLVMUNBOGRR-UHFFFAOYSA-N
Molecular Formula	C₁₀H₂₀O₂

TraceCERT™ Methyl Palmitate, Certified Reference Material, MilliporeSigma™ Supelco™

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.

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Fatty acid esters

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