Fatty acid conjugates

Positional and geometric isomers of fatty acids with conjugated double bonds; implies four consecutive unsaturated links, and results in a delocalization of electrons along the double-bonded carbons; available in carbon chains of varying length.

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421 – 435 of 2,409 results

421

Monomethyl Itaconate 98.0+%, TCI America™

CAS: 7338-27-4 Molecular Formula: C6H8O4 Molecular Weight (g/mol): 144.126 MDL Number: MFCD00021713 InChI Key: OIYTYGOUZOARSH-UHFFFAOYSA-N Synonym: Itaconic Acid Monomethyl Ester, beta-Methyl Itaconate, 4-Methyl Methylenesuccinate PubChem CID: 81791 IUPAC Name: 4-methoxy-2-methylidene-4-oxobutanoic acid SMILES: COC(=O)CC(=C)C(=O)O

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PubChem CID	81791
CAS	7338-27-4
Molecular Weight (g/mol)	144.126
MDL Number	MFCD00021713
SMILES	COC(=O)CC(=C)C(=O)O
Synonym	Itaconic Acid Monomethyl Ester, beta-Methyl Itaconate, 4-Methyl Methylenesuccinate
IUPAC Name	4-methoxy-2-methylidene-4-oxobutanoic acid
InChI Key	OIYTYGOUZOARSH-UHFFFAOYSA-N
Molecular Formula	C6H8O4

422

Hexanoic Acid 98.0+%, TCI America™

CAS: 142-62-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00004421 InChI Key: FUZZWVXGSFPDMH-UHFFFAOYSA-N Synonym: caproic acid,capronic acid,n-hexanoic acid,n-caproic acid,butylacetic acid,hexoic acid,pentylformic acid,1-hexanoic acid,n-hexylic acid,n-hexoic acid PubChem CID: 8892 ChEBI: CHEBI:30776 IUPAC Name: hexanoic acid SMILES: CCCCCC(=O)O

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Specifications

PubChem CID	8892
CAS	142-62-1
Molecular Weight (g/mol)	116.16
ChEBI	CHEBI:30776
MDL Number	MFCD00004421
SMILES	CCCCCC(=O)O
Synonym	caproic acid,capronic acid,n-hexanoic acid,n-caproic acid,butylacetic acid,hexoic acid,pentylformic acid,1-hexanoic acid,n-hexylic acid,n-hexoic acid
IUPAC Name	hexanoic acid
InChI Key	FUZZWVXGSFPDMH-UHFFFAOYSA-N
Molecular Formula	C6H12O2

423

trans-2-Hexenoic Acid 98.0+%, TCI America™

CAS: 13419-69-7 Molecular Formula: C6H9O2 Molecular Weight (g/mol): 113.14 MDL Number: MFCD00002705 InChI Key: NIONDZDPPYHYKY-SNAWJCMRSA-M Synonym: trans-2-hexenoic acid,2-hexenoic acid,e-hex-2-enoic acid,hex-2-enoic acid,trans-hex-2-enoic acid,e-2-hexenoic acid,hexenoic acid,2e-hex-2-enoic acid,2-hexenoic acid, 2e,2-hexenoic acid, e PubChem CID: 5282707 ChEBI: CHEBI:87721 IUPAC Name: (2E)-hex-2-enoate SMILES: CCC\C=C\C([O-])=O

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PubChem CID	5282707
CAS	13419-69-7
Molecular Weight (g/mol)	113.14
ChEBI	CHEBI:87721
MDL Number	MFCD00002705
SMILES	CCC\C=C\C([O-])=O
Synonym	trans-2-hexenoic acid,2-hexenoic acid,e-hex-2-enoic acid,hex-2-enoic acid,trans-hex-2-enoic acid,e-2-hexenoic acid,hexenoic acid,2e-hex-2-enoic acid,2-hexenoic acid, 2e,2-hexenoic acid, e
IUPAC Name	(2E)-hex-2-enoate
InChI Key	NIONDZDPPYHYKY-SNAWJCMRSA-M
Molecular Formula	C6H9O2

424

5-Hexynoic Acid 96.0+%, TCI America™

CAS: 53293-00-8 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00066346 InChI Key: VPFMEXRVUOPYRG-UHFFFAOYSA-N Synonym: 5-hexynoic acid,5-hexyn-1-oic acid,4-ethynylbutyric acid,acmc-1an4h PubChem CID: 143036 ChEBI: CHEBI:73511 IUPAC Name: hex-5-ynoic acid SMILES: C#CCCCC(=O)O

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Specifications

PubChem CID	143036
CAS	53293-00-8
Molecular Weight (g/mol)	112.128
ChEBI	CHEBI:73511
MDL Number	MFCD00066346
SMILES	C#CCCCC(=O)O
Synonym	5-hexynoic acid,5-hexyn-1-oic acid,4-ethynylbutyric acid,acmc-1an4h
IUPAC Name	hex-5-ynoic acid
InChI Key	VPFMEXRVUOPYRG-UHFFFAOYSA-N
Molecular Formula	C6H8O2

425

3-Bromopropyl Acetate 95.0+%, TCI America™

CAS: 592-33-6 Molecular Formula: C5H9BrO2 MDL Number: MFCD02258489 Synonym: Acetic Acid 3-Bromopropyl Ester

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Specifications

CAS	592-33-6
MDL Number	MFCD02258489
Synonym	Acetic Acid 3-Bromopropyl Ester
Molecular Formula	C5H9BrO2

426

(S)-2-(tert-Butoxycarbonylamino)butyric Acid 98.0+%, TCI America™

CAS: 34306-42-8 Molecular Formula: C9H17NO4 Molecular Weight (g/mol): 203.24 MDL Number: MFCD00037267 InChI Key: PNFVIPIQXAIUAY-UHFFFAOYNA-N Synonym: boc-abu-oh,boc-l-2-aminobutyric acid,boc-2-abu-oh,s-2-tert-butoxycarbonyl amino butanoic acid,boc-l-2-aminobutanoic acid,boc-l-abu-oh,s-2-tert-butoxycarbonylamino butyric acid,s-2-boc-amino butyric acid,2s-2-tert-butoxycarbonyl amino butanoic acid,l-2-boc-amino butyric acid PubChem CID: 2755934 IUPAC Name: 2-{[(tert-butoxy)carbonyl]amino}butanoic acid SMILES: CCC(NC(=O)OC(C)(C)C)C(O)=O

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PubChem CID	2755934
CAS	34306-42-8
Molecular Weight (g/mol)	203.24
MDL Number	MFCD00037267
SMILES	CCC(NC(=O)OC(C)(C)C)C(O)=O
Synonym	boc-abu-oh,boc-l-2-aminobutyric acid,boc-2-abu-oh,s-2-tert-butoxycarbonyl amino butanoic acid,boc-l-2-aminobutanoic acid,boc-l-abu-oh,s-2-tert-butoxycarbonylamino butyric acid,s-2-boc-amino butyric acid,2s-2-tert-butoxycarbonyl amino butanoic acid,l-2-boc-amino butyric acid
IUPAC Name	2-{[(tert-butoxy)carbonyl]amino}butanoic acid
InChI Key	PNFVIPIQXAIUAY-UHFFFAOYNA-N
Molecular Formula	C9H17NO4

427

(R)-2-Bromo-3-methylbutyric Acid 98.0+%, TCI America™

CAS: 76792-22-8 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.03 MDL Number: MFCD00210113 InChI Key: UEBARDWJXBGYEJ-SCSAIBSYSA-N Synonym: (R)-2-Bromoisovaleric Acid PubChem CID: 156968 IUPAC Name: (2R)-2-bromo-3-methylbutanoic acid SMILES: CC(C)[C@@H](Br)C(O)=O

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Specifications

PubChem CID	156968
CAS	76792-22-8
Molecular Weight (g/mol)	181.03
MDL Number	MFCD00210113
SMILES	CC(C)[C@@H](Br)C(O)=O
Synonym	(R)-2-Bromoisovaleric Acid
IUPAC Name	(2R)-2-bromo-3-methylbutanoic acid
InChI Key	UEBARDWJXBGYEJ-SCSAIBSYSA-N
Molecular Formula	C5H9BrO2

428

Tridecanoic Acid 98.0+%, TCI America™

CAS: 638-53-9 Molecular Formula: C13H26O2 Molecular Weight (g/mol): 214.349 MDL Number: MFCD00002741 InChI Key: SZHOJFHSIKHZHA-UHFFFAOYSA-N Synonym: n-tridecanoic acid,tridecylic acid,n-tridecoic acid,unii-19936liy2v,anion,tridecanoic acid,wln: qv12,c10-16 fatty acids,fatty acids, c10-16,carboxylic acids, c10-16 PubChem CID: 12530 ChEBI: CHEBI:45919 IUPAC Name: tridecanoic acid SMILES: CCCCCCCCCCCCC(=O)O

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PubChem CID	12530
CAS	638-53-9
Molecular Weight (g/mol)	214.349
ChEBI	CHEBI:45919
MDL Number	MFCD00002741
SMILES	CCCCCCCCCCCCC(=O)O
Synonym	n-tridecanoic acid,tridecylic acid,n-tridecoic acid,unii-19936liy2v,anion,tridecanoic acid,wln: qv12,c10-16 fatty acids,fatty acids, c10-16,carboxylic acids, c10-16
IUPAC Name	tridecanoic acid
InChI Key	SZHOJFHSIKHZHA-UHFFFAOYSA-N
Molecular Formula	C13H26O2

429

Valeric Acid 98.0+%, TCI America™

CAS: 109-52-4 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00004413 InChI Key: NQPDZGIKBAWPEJ-UHFFFAOYSA-N Synonym: valeric acid,n-valeric acid,n-pentanoic acid,valerianic acid,1-butanecarboxylic acid,propylacetic acid,butanecarboxylic acid,pentoic acid,kyselina valerova,valeric acid, n PubChem CID: 7991 ChEBI: CHEBI:17418 IUPAC Name: pentanoic acid SMILES: CCCCC(=O)O

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PubChem CID	7991
CAS	109-52-4
Molecular Weight (g/mol)	102.133
ChEBI	CHEBI:17418
MDL Number	MFCD00004413
SMILES	CCCCC(=O)O
Synonym	valeric acid,n-valeric acid,n-pentanoic acid,valerianic acid,1-butanecarboxylic acid,propylacetic acid,butanecarboxylic acid,pentoic acid,kyselina valerova,valeric acid, n
IUPAC Name	pentanoic acid
InChI Key	NQPDZGIKBAWPEJ-UHFFFAOYSA-N
Molecular Formula	C5H10O2

430

Nonadecanedioic Acid 98.0+%, TCI America™

CAS: 6250-70-0 Molecular Formula: C19H36O4 Molecular Weight (g/mol): 328.49 MDL Number: MFCD00039536 InChI Key: IFAWYXIHOVRGHQ-UHFFFAOYSA-N Synonym: 1,17-Heptadecanedicarboxylic Acid PubChem CID: 12572015 IUPAC Name: nonadecanedioic acid SMILES: OC(=O)CCCCCCCCCCCCCCCCCC(O)=O

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Specifications

PubChem CID	12572015
CAS	6250-70-0
Molecular Weight (g/mol)	328.49
MDL Number	MFCD00039536
SMILES	OC(=O)CCCCCCCCCCCCCCCCCC(O)=O
Synonym	1,17-Heptadecanedicarboxylic Acid
IUPAC Name	nonadecanedioic acid
InChI Key	IFAWYXIHOVRGHQ-UHFFFAOYSA-N
Molecular Formula	C19H36O4

431

1,9-Nonanedicarboxylic Acid 97.0+%, TCI America™

CAS: 1852-04-6 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.28 MDL Number: MFCD00004444 InChI Key: LWBHHRRTOZQPDM-UHFFFAOYSA-N Synonym: 1,9-nonanedicarboxylic acid,1,11-undecanedioic acid,undecanedionic acid,1,9-nonanedicarboxylicacid,undecandioic acid,hendecanedioic acid,unii-7059gfk8nv,nonamethylenedicarboxylic acid,hendecanedioate,undecanedioate PubChem CID: 15816 ChEBI: CHEBI:73713 IUPAC Name: undecanedioic acid SMILES: OC(=O)CCCCCCCCCC(O)=O

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Specifications

PubChem CID	15816
CAS	1852-04-6
Molecular Weight (g/mol)	216.28
ChEBI	CHEBI:73713
MDL Number	MFCD00004444
SMILES	OC(=O)CCCCCCCCCC(O)=O
Synonym	1,9-nonanedicarboxylic acid,1,11-undecanedioic acid,undecanedionic acid,1,9-nonanedicarboxylicacid,undecandioic acid,hendecanedioic acid,unii-7059gfk8nv,nonamethylenedicarboxylic acid,hendecanedioate,undecanedioate
IUPAC Name	undecanedioic acid
InChI Key	LWBHHRRTOZQPDM-UHFFFAOYSA-N
Molecular Formula	C11H20O4

432

Tianeptine Sodium Salt Hydrate 98.0+%, TCI America™

CAS: 30123-17-2 Molecular Formula: C21H24ClN2NaO4S Molecular Weight (g/mol): 458.933 MDL Number: MFCD00879851 InChI Key: ZLBSUOGMZDXYKE-UHFFFAOYSA-M Synonym: tianeptine sodium,tianeptine sodium salt,stablon,tatinol,coaxil,+-tianeptine monosodium salt,tianeptine sodium, +,sodium 7-3-chloro-6,11-dihydro-6-methyldibenzo c,f 1,2 thiazepin-11-yl amino heptanoate s,s-dioxide,7-3-chloro-6,11-dihydro-6-methyldibenzo c,f 1,2 thiazepin-11-yl amino heptanoic acid s,s-dioxide sodium salt PubChem CID: 23663953 IUPAC Name: sodium;7-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-yl)amino]heptanoate SMILES: CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)Cl)NCCCCCCC(=O)[O-].[Na+]

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Specifications

PubChem CID	23663953
CAS	30123-17-2
Molecular Weight (g/mol)	458.933
MDL Number	MFCD00879851
SMILES	CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)Cl)NCCCCCCC(=O)[O-].[Na+]
Synonym	tianeptine sodium,tianeptine sodium salt,stablon,tatinol,coaxil,+-tianeptine monosodium salt,tianeptine sodium, +,sodium 7-3-chloro-6,11-dihydro-6-methyldibenzo c,f 1,2 thiazepin-11-yl amino heptanoate s,s-dioxide,7-3-chloro-6,11-dihydro-6-methyldibenzo c,f 1,2 thiazepin-11-yl amino heptanoic acid s,s-dioxide sodium salt
IUPAC Name	sodium;7-[(3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-yl)amino]heptanoate
InChI Key	ZLBSUOGMZDXYKE-UHFFFAOYSA-M
Molecular Formula	C21H24ClN2NaO4S

433

Pyrilamine Maleate 98.0+%, TCI America™

CAS: 59-33-6 Molecular Formula: C21H27N3O5 Molecular Weight (g/mol): 401.46 MDL Number: MFCD00069333 InChI Key: JXYWFNAQESKDNC-BTJKTKAUSA-N Synonym: pyrilamine maleate,mepyramine maleate,anisopyradamine,histosol,minihist,diaminide maleate,paraminyl maleate,antihist,histatex,histine PubChem CID: 5284451 IUPAC Name: (2Z)-but-2-enedioic acid; N-[2-(dimethylamino)ethyl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine SMILES: OC(=O)\C=C/C(O)=O.COC1=CC=C(CN(CCN(C)C)C2=CC=CC=N2)C=C1

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Specifications

PubChem CID	5284451
CAS	59-33-6
Molecular Weight (g/mol)	401.46
MDL Number	MFCD00069333
SMILES	OC(=O)\C=C/C(O)=O.COC1=CC=C(CN(CCN(C)C)C2=CC=CC=N2)C=C1
Synonym	pyrilamine maleate,mepyramine maleate,anisopyradamine,histosol,minihist,diaminide maleate,paraminyl maleate,antihist,histatex,histine
IUPAC Name	(2Z)-but-2-enedioic acid; N-[2-(dimethylamino)ethyl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
InChI Key	JXYWFNAQESKDNC-BTJKTKAUSA-N
Molecular Formula	C21H27N3O5

434

4-Chlorobutyric Acid 95.0+%, TCI America™

CAS: 627-00-9 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.548 MDL Number: MFCD00002818 InChI Key: IPLKGJHGWCVSOG-UHFFFAOYSA-N Synonym: 4-chlorobutyric acid,butanoic acid, 4-chloro,butyric acid, 4-chloro,gamma-chlorobutyric acid,4-chlorobutanoicacid,gammachlorobutyric acid,4-chloro-butyric acid,4-chloro-n-butyric acid,.gamma.-chlorobutyric acid,4-chloranylbutanoic acid PubChem CID: 12300 IUPAC Name: 4-chlorobutanoic acid SMILES: C(CC(=O)O)CCl

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PubChem CID	12300
CAS	627-00-9
Molecular Weight (g/mol)	122.548
MDL Number	MFCD00002818
SMILES	C(CC(=O)O)CCl
Synonym	4-chlorobutyric acid,butanoic acid, 4-chloro,butyric acid, 4-chloro,gamma-chlorobutyric acid,4-chlorobutanoicacid,gammachlorobutyric acid,4-chloro-butyric acid,4-chloro-n-butyric acid,.gamma.-chlorobutyric acid,4-chloranylbutanoic acid
IUPAC Name	4-chlorobutanoic acid
InChI Key	IPLKGJHGWCVSOG-UHFFFAOYSA-N
Molecular Formula	C4H7ClO2

435

Calcium Sorbate 95.0+%, TCI America™

CAS: 7492-55-9 Molecular Formula: C12H14CaO4 Molecular Weight (g/mol): 262.32 MDL Number: MFCD00043805 InChI Key: MCFVRESNTICQSJ-RJNTXXOISA-L Synonym: Sorbic Acid Calcium Salt PubChem CID: 6433506 IUPAC Name: calcium bis((2E,4E)-hexa-2,4-dienoate) SMILES: [Ca++].C\C=C\C=C\C([O-])=O.C\C=C\C=C\C([O-])=O

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Specifications

PubChem CID	6433506
CAS	7492-55-9
Molecular Weight (g/mol)	262.32
MDL Number	MFCD00043805
SMILES	[Ca++].C\C=C\C=C\C([O-])=O.C\C=C\C=C\C([O-])=O
Synonym	Sorbic Acid Calcium Salt
IUPAC Name	calcium bis((2E,4E)-hexa-2,4-dienoate)
InChI Key	MCFVRESNTICQSJ-RJNTXXOISA-L
Molecular Formula	C12H14CaO4

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