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Details

Stereochemistry RACEMIC
Molecular Formula C9H18O2
Molecular Weight 158.238
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYLOCTANOIC ACID

SMILES

CCCCC(C)CCC(O)=O

InChI

InChIKey=LEGGANXCVQPIAI-UHFFFAOYSA-N
InChI=1S/C9H18O2/c1-3-4-5-8(2)6-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11)

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Desulfoglaeba alkanexedens gen. nov., sp. nov., an n-alkane-degrading, sulfate-reducing bacterium.
2006 Dec
Name Type Language
4-METHYLOCTANOIC ACID
FHFI  
Systematic Name English
(±)-4-METHYLOCTANOIC ACID
Systematic Name English
4-METHYL OCTANOIC ACID
Systematic Name English
4-METHYLCAPRYLIC ACID
Systematic Name English
OCTANOIC ACID, 4-METHYL-
Common Name English
FEMA NO. 3575
Code English
HIRCINOIC ACID
Common Name English
4-METHYLOCTANOIC ACID, (±)-
Common Name English
4-METHYLOCTANOIC ACID [FHFI]
Common Name English
Classification Tree Code System Code
JECFA EVALUATION 4-METHYLOCTANOIC ACID
Created by admin on Fri Dec 15 19:40:03 GMT 2023 , Edited by admin on Fri Dec 15 19:40:03 GMT 2023
Code System Code Type Description
JECFA MONOGRAPH
57
Created by admin on Fri Dec 15 19:40:03 GMT 2023 , Edited by admin on Fri Dec 15 19:40:03 GMT 2023
PRIMARY
PUBCHEM
62089
Created by admin on Fri Dec 15 19:40:03 GMT 2023 , Edited by admin on Fri Dec 15 19:40:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID70866453
Created by admin on Fri Dec 15 19:40:03 GMT 2023 , Edited by admin on Fri Dec 15 19:40:03 GMT 2023
PRIMARY
ECHA (EC/EINECS)
259-404-2
Created by admin on Fri Dec 15 19:40:03 GMT 2023 , Edited by admin on Fri Dec 15 19:40:03 GMT 2023
PRIMARY
FDA UNII
5545264N9R
Created by admin on Fri Dec 15 19:40:03 GMT 2023 , Edited by admin on Fri Dec 15 19:40:03 GMT 2023
PRIMARY
CAS
54947-74-9
Created by admin on Fri Dec 15 19:40:03 GMT 2023 , Edited by admin on Fri Dec 15 19:40:03 GMT 2023
PRIMARY