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Details

Stereochemistry ACHIRAL
Molecular Formula C7H14O2
Molecular Weight 130.1849
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-METHYL HEXANOIC ACID

SMILES

CC(C)CCCC(O)=O

InChI

InChIKey=MHPUGCYGQWGLJL-UHFFFAOYSA-N
InChI=1S/C7H14O2/c1-6(2)4-3-5-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)

HIDE SMILES / InChI

Molecular Formula C7H14O2
Molecular Weight 130.1849
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Ion-exclusion chromatographic separations of C1-C6 aliphatic carboxylic acids on a sulfonated styrene-divinylbenzene co-polymer resin column with 5-methylhexanoic acid as eluent.
2003 May 16
Activation of the anterior cingulate gyrus by 'Green Odor': a positron emission tomography study in the monkey.
2003 Sep
Estimating firing rates from calcium signals in locust projection neurons in vivo.
2007
Hypertrophy is induced during the in vitro chondrogenic differentiation of human mesenchymal stem cells by bone morphogenetic protein-2 and bone morphogenetic protein-4 gene transfer.
2009
Patterns of cerebral activation during olfactory and trigeminal stimulations.
2009 Mar
In vitro antibacterial and morphological effects of the urushiol component of the sap of the Korean lacquer tree (Rhus vernicifera Stokes) on Helicobacter pylori.
2010 Mar
Temporal and spatial expression of Muc1 during implantation in sows.
2010 May 27
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:59:41 GMT 2023
Edited
by admin
on Fri Dec 15 18:59:41 GMT 2023
Record UNII
N1AK4X34C2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-METHYL HEXANOIC ACID
Systematic Name English
FEMA NO. 3572
Code English
ISOHEPTANOIC ACID
Systematic Name English
ISOVENANTHIC ACID
Common Name English
CAPROIC ACID, .DELTA.-METHYL-
Common Name English
5-METHYLHEXANOIC ACID [FHFI]
Common Name English
ISOENANTHIC ACID
Common Name English
NSC-1075
Code English
HEXANOIC ACID, 5-METHYL-
Common Name English
5-METHYLHEXANOIC ACID
FHFI  
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION 5-METHYLHEXANOIC ACID
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID8044252
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
CAS
628-46-6
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
FDA UNII
N1AK4X34C2
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
PUBCHEM
12344
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
JECFA MONOGRAPH
647
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY
NSC
1075
Created by admin on Fri Dec 15 18:59:41 GMT 2023 , Edited by admin on Fri Dec 15 18:59:41 GMT 2023
PRIMARY