U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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 HEPTANOIC ACID

SMILES

CCCCCCC(O)=O

InChI

InChIKey=MNWFXJYAOYHMED-UHFFFAOYSA-N
InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(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

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:15:28 UTC 2023
Edited
by admin
on Sat Dec 16 05:15:28 UTC 2023
Record UNII
THE3YNP39D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEPTANOIC ACID
FHFI   HSDB   MI  
Systematic Name English
HEPTANOIC ACID [HSDB]
Common Name English
OENANTHYLIC ACID
Common Name English
HEPTOIC ACID
Common Name English
FEMA NO. 3348
Code English
HEPTANOIC AICD-
Common Name English
TESTOSTERONE ENANTATE IMPURITY A [EP IMPURITY]
Common Name English
NSC-2192
Code English
ENANTHIC ACID
Systematic Name English
HEPTANOIC ACID [FHFI]
Common Name English
1-HEXANECARBOXYLIC ACID
Systematic Name English
HEPTYLIC ACID
Common Name English
ENANTHIC ACID [USP-RS]
Common Name English
N-HEPTANOIC ACID
Common Name English
ENANTHYLIC ACID
Common Name English
HEPTANOIC ACID [MI]
Common Name English
OENANTHIC ACID
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C345
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
JECFA EVALUATION HEPTANOIC ACID
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
Code System Code Type Description
PUBCHEM
8094
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
EPA CompTox
DTXSID2021600
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
ECHA (EC/EINECS)
203-838-7
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
CHEBI
45571
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
HSDB
5546
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
RXCUI
991260
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY RxNorm
NSC
2192
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
WIKIPEDIA
HEPTANOIC ACID
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
NCI_THESAURUS
C61782
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
CAS
111-14-8
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
DRUG BANK
DB02938
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
JECFA MONOGRAPH
267
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
RS_ITEM_NUM
1235398
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
DAILYMED
THE3YNP39D
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
FDA UNII
THE3YNP39D
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY
MERCK INDEX
m5965
Created by admin on Sat Dec 16 05:15:28 UTC 2023 , Edited by admin on Sat Dec 16 05:15:28 UTC 2023
PRIMARY Merck Index
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Related Record Type Details
ACTIVE MOIETY