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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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1

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.

2

Methyl oleate, 99%, analytical standard for GC

CAS: 112-62-9 Molecular Formula: C19H36O2 Molecular Weight (g/mol): 296.48 InChI Key: QYDYPVFESGNLHU-KHPPLWFESA-N Synonym: methyl oleate,oleic acid methyl ester,methyl cis-9-octadecenoate,oleic acid, methyl ester,edenor metio5,methyl z-9-octadecenoate,methyl-cis-oleate,exceparl m-ol,emery, oleic acid ester,esterol 112 PubChem CID: 5364509 ChEBI: CHEBI:27542 IUPAC Name: methyl (Z)-octadec-9-enoate SMILES: CCCCCCCCC=CCCCCCCCC(=O)OC

PubChem CID 5364509
CAS 112-62-9
Molecular Weight (g/mol) 296.48
ChEBI CHEBI:27542
SMILES CCCCCCCCC=CCCCCCCCC(=O)OC
Synonym methyl oleate,oleic acid methyl ester,methyl cis-9-octadecenoate,oleic acid, methyl ester,edenor metio5,methyl z-9-octadecenoate,methyl-cis-oleate,exceparl m-ol,emery, oleic acid ester,esterol 112
IUPAC Name methyl (Z)-octadec-9-enoate
InChI Key QYDYPVFESGNLHU-KHPPLWFESA-N
Molecular Formula C19H36O2
3

Methyl palmitoleate, 99%, analytical standard for GC

CAS: 1120-25-8 Molecular Formula: C17H32O2 Molecular Weight (g/mol): 268.44 MDL Number: MFCD00042911 InChI Key: IZFGRAGOVZCUFB-HJWRWDBZSA-N Synonym: methyl palmitoleate,z-methyl hexadec-9-enoate,methyl z-hexadec-9-enoate,methyl palmitoleinate,unii-35695qdb9f,methyl 9z-hexadec-9-enoate,9-hexadecenoic acid, methyl ester, z,methyl cis-9-hexadecenoate,methyl z-9-hexadecenoate,methyl cis-hexadec-9-enoate PubChem CID: 643801 ChEBI: CHEBI:84156 IUPAC Name: methyl (Z)-hexadec-9-enoate SMILES: CCCCCC\C=C/CCCCCCCC(=O)OC

PubChem CID 643801
CAS 1120-25-8
Molecular Weight (g/mol) 268.44
ChEBI CHEBI:84156
MDL Number MFCD00042911
SMILES CCCCCC\C=C/CCCCCCCC(=O)OC
Synonym methyl palmitoleate,z-methyl hexadec-9-enoate,methyl z-hexadec-9-enoate,methyl palmitoleinate,unii-35695qdb9f,methyl 9z-hexadec-9-enoate,9-hexadecenoic acid, methyl ester, z,methyl cis-9-hexadecenoate,methyl z-9-hexadecenoate,methyl cis-hexadec-9-enoate
IUPAC Name methyl (Z)-hexadec-9-enoate
InChI Key IZFGRAGOVZCUFB-HJWRWDBZSA-N
Molecular Formula C17H32O2
4

Methyl palmitate, 99%, analytical standard for GC

CAS: 112-39-0 Molecular Formula: C17H34O2 Molecular Weight (g/mol): 270.45 InChI Key: FLIACVVOZYBSBS-UHFFFAOYSA-N Synonym: methyl palmitate,palmitic acid methyl ester,hexadecanoic acid, methyl ester,palmitic acid, methyl ester,uniphat a60,metholene 2216,methyl n-hexadecanoate,hexadecanoic acid methyl ester,n-hexadecanoic acid methyl ester,unii-dpy8vcm98i PubChem CID: 8181 ChEBI: CHEBI:69187 IUPAC Name: methyl hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OC

PubChem CID 8181
CAS 112-39-0
Molecular Weight (g/mol) 270.45
ChEBI CHEBI:69187
SMILES CCCCCCCCCCCCCCCC(=O)OC
Synonym methyl palmitate,palmitic acid methyl ester,hexadecanoic acid, methyl ester,palmitic acid, methyl ester,uniphat a60,metholene 2216,methyl n-hexadecanoate,hexadecanoic acid methyl ester,n-hexadecanoic acid methyl ester,unii-dpy8vcm98i
IUPAC Name methyl hexadecanoate
InChI Key FLIACVVOZYBSBS-UHFFFAOYSA-N
Molecular Formula C17H34O2
5

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

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
6

Methyl oleate, tech. C18 71-90%, C18:1 >65% of C18

CAS: 112-62-9 Molecular Formula: C19H36O2 Molecular Weight (g/mol): 296.495 MDL Number: MFCD00009578 InChI Key: QYDYPVFESGNLHU-KHPPLWFESA-N Synonym: methyl oleate,oleic acid methyl ester,methyl cis-9-octadecenoate,oleic acid, methyl ester,edenor metio5,methyl z-9-octadecenoate,methyl-cis-oleate,exceparl m-ol,emery, oleic acid ester,esterol 112 PubChem CID: 5364509 ChEBI: CHEBI:27542 IUPAC Name: methyl (Z)-octadec-9-enoate SMILES: CCCCCCCCC=CCCCCCCCC(=O)OC

PubChem CID 5364509
CAS 112-62-9
Molecular Weight (g/mol) 296.495
ChEBI CHEBI:27542
MDL Number MFCD00009578
SMILES CCCCCCCCC=CCCCCCCCC(=O)OC
Synonym methyl oleate,oleic acid methyl ester,methyl cis-9-octadecenoate,oleic acid, methyl ester,edenor metio5,methyl z-9-octadecenoate,methyl-cis-oleate,exceparl m-ol,emery, oleic acid ester,esterol 112
IUPAC Name methyl (Z)-octadec-9-enoate
InChI Key QYDYPVFESGNLHU-KHPPLWFESA-N
Molecular Formula C19H36O2
7

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
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
8

Methyl eicosanoate, 98+%

CAS: 1120-28-1 Molecular Formula: C21H42O2 Molecular Weight (g/mol): 326.57 MDL Number: MFCD00009014 InChI Key: QGBRLVONZXHAKJ-UHFFFAOYSA-N Synonym: methyl arachidate,eicosanoic acid, methyl ester,arachidic acid methyl ester,methyl eicosanoate,methyl arachisate,arachidic acid methylester,eicosanoic acid methyl ester,methylarachidate,methyl aracidate PubChem CID: 14259 IUPAC Name: methyl icosanoate SMILES: CCCCCCCCCCCCCCCCCCCC(=O)OC

PubChem CID 14259
CAS 1120-28-1
Molecular Weight (g/mol) 326.57
MDL Number MFCD00009014
SMILES CCCCCCCCCCCCCCCCCCCC(=O)OC
Synonym methyl arachidate,eicosanoic acid, methyl ester,arachidic acid methyl ester,methyl eicosanoate,methyl arachisate,arachidic acid methylester,eicosanoic acid methyl ester,methylarachidate,methyl aracidate
IUPAC Name methyl icosanoate
InChI Key QGBRLVONZXHAKJ-UHFFFAOYSA-N
Molecular Formula C21H42O2
9

Dimethyl pimelate, 98+%

CAS: 1732-08-7 Molecular Formula: C9H16O4 Molecular Weight (g/mol): 188.22 MDL Number: MFCD00008470 InChI Key: SHWINQXIGSEZAP-UHFFFAOYSA-N Synonym: dimethyl pimelate,heptanedioic acid, dimethyl ester,pimelic acid dimethyl ester,pimelic acid, dimethyl ester,dimethyl 1,7-heptanedioate,1,7-dimethyl heptanedioate,heptanedioic acid, 1,7-dimethyl ester,unii-ge1pf3049f,heptanedioic acid dimethyl ester,1ov5vo1 PubChem CID: 74416 IUPAC Name: dimethyl heptanedioate SMILES: COC(=O)CCCCCC(=O)OC

PubChem CID 74416
CAS 1732-08-7
Molecular Weight (g/mol) 188.22
MDL Number MFCD00008470
SMILES COC(=O)CCCCCC(=O)OC
Synonym dimethyl pimelate,heptanedioic acid, dimethyl ester,pimelic acid dimethyl ester,pimelic acid, dimethyl ester,dimethyl 1,7-heptanedioate,1,7-dimethyl heptanedioate,heptanedioic acid, 1,7-dimethyl ester,unii-ge1pf3049f,heptanedioic acid dimethyl ester,1ov5vo1
IUPAC Name dimethyl heptanedioate
InChI Key SHWINQXIGSEZAP-UHFFFAOYSA-N
Molecular Formula C9H16O4
10

Methyl 4-chlorobutyrate, 98%

CAS: 3153-37-5 Molecular Formula: C5H9ClO2 Molecular Weight (g/mol): 136.575 MDL Number: MFCD00001003 InChI Key: ZZUYIRISBMWFMV-UHFFFAOYSA-N Synonym: methyl 4-chlorobutyrate,butanoic acid, 4-chloro-, methyl ester,4-chlorobutyric acid methyl ester,butyric acid, 4-chloro-, methyl ester,methyl .omega.-chlorobutyrate,4-chlorobutanoic acid methyl ester,.gamma.-chlorobutyric acid methyl ester,methyl-4-chlorbutanoat,gamma-chlorobutyric acid methyl ester,methyl omega-chlorobutyrate PubChem CID: 76612 IUPAC Name: methyl 4-chlorobutanoate SMILES: COC(=O)CCCCl

PubChem CID 76612
CAS 3153-37-5
Molecular Weight (g/mol) 136.575
MDL Number MFCD00001003
SMILES COC(=O)CCCCl
Synonym methyl 4-chlorobutyrate,butanoic acid, 4-chloro-, methyl ester,4-chlorobutyric acid methyl ester,butyric acid, 4-chloro-, methyl ester,methyl .omega.-chlorobutyrate,4-chlorobutanoic acid methyl ester,.gamma.-chlorobutyric acid methyl ester,methyl-4-chlorbutanoat,gamma-chlorobutyric acid methyl ester,methyl omega-chlorobutyrate
IUPAC Name methyl 4-chlorobutanoate
InChI Key ZZUYIRISBMWFMV-UHFFFAOYSA-N
Molecular Formula C5H9ClO2
11

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
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
12

Methyl isovalerate, 98%

CAS: 556-24-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00042866 InChI Key: OQAGVSWESNCJJT-UHFFFAOYSA-N Synonym: methyl isovalerate,methyl isopentanoate,methyl 3-methylbutyrate,isovaleric acid, methyl ester,butanoic acid, 3-methyl-, methyl ester,methyl isovalerianate,methylisovalerate,isovaleric acid methyl ester,methyl isovalerate natural,fema no. 2753 PubChem CID: 11160 IUPAC Name: methyl 3-methylbutanoate SMILES: CC(C)CC(=O)OC

PubChem CID 11160
CAS 556-24-1
Molecular Weight (g/mol) 116.16
MDL Number MFCD00042866
SMILES CC(C)CC(=O)OC
Synonym methyl isovalerate,methyl isopentanoate,methyl 3-methylbutyrate,isovaleric acid, methyl ester,butanoic acid, 3-methyl-, methyl ester,methyl isovalerianate,methylisovalerate,isovaleric acid methyl ester,methyl isovalerate natural,fema no. 2753
IUPAC Name methyl 3-methylbutanoate
InChI Key OQAGVSWESNCJJT-UHFFFAOYSA-N
Molecular Formula C6H12O2
13

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
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
14

Methyl 4,4,4-trifluoroacetoacetate, 95%

CAS: 83643-84-9 Molecular Formula: C5H5F3O3 Molecular Weight (g/mol): 170.087 MDL Number: MFCD00041004 InChI Key: LKMUBWWZTSZGGV-UHFFFAOYSA-N PubChem CID: 550266 IUPAC Name: methyl 4,4,4-trifluoro-3-oxobutanoate SMILES: COC(=O)CC(=O)C(F)(F)F

PubChem CID 550266
CAS 83643-84-9
Molecular Weight (g/mol) 170.087
MDL Number MFCD00041004
SMILES COC(=O)CC(=O)C(F)(F)F
IUPAC Name methyl 4,4,4-trifluoro-3-oxobutanoate
InChI Key LKMUBWWZTSZGGV-UHFFFAOYSA-N
Molecular Formula C5H5F3O3
15

Methyl adipoyl chloride, 96%

CAS: 35444-44-1 Molecular Formula: C7H11ClO3 Molecular Weight (g/mol): 178.61 MDL Number: MFCD00013661 InChI Key: HDLGIEZOMYJKAK-UHFFFAOYSA-N Synonym: hexanedioic acid monochloride monomethyl ester,hexanoic acid, 6-chloro-6-oxo-, methyl ester,6-methoxy-6-oxohexanoyl chloride,methyl 5-chloroformyl pentanoate,5-chlorocarbonyl-pentanoic acid methyl ester,mono-methyl adipoyl chloride,5-carbomethoxyvaleryl chloride,methyl 6-chloro-6-oxocaproate,methyl adipoyl chloride PubChem CID: 520737 IUPAC Name: methyl 6-chloro-6-oxohexanoate SMILES: COC(=O)CCCCC(Cl)=O

PubChem CID 520737
CAS 35444-44-1
Molecular Weight (g/mol) 178.61
MDL Number MFCD00013661
SMILES COC(=O)CCCCC(Cl)=O
Synonym hexanedioic acid monochloride monomethyl ester,hexanoic acid, 6-chloro-6-oxo-, methyl ester,6-methoxy-6-oxohexanoyl chloride,methyl 5-chloroformyl pentanoate,5-chlorocarbonyl-pentanoic acid methyl ester,mono-methyl adipoyl chloride,5-carbomethoxyvaleryl chloride,methyl 6-chloro-6-oxocaproate,methyl adipoyl chloride
IUPAC Name methyl 6-chloro-6-oxohexanoate
InChI Key HDLGIEZOMYJKAK-UHFFFAOYSA-N
Molecular Formula C7H11ClO3