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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 PROPYL BUTYRATE

SMILES

CCCOC(=O)CCC

InChI

InChIKey=HUAZGNHGCJGYNP-UHFFFAOYSA-N
InChI=1S/C7H14O2/c1-3-5-7(8)9-6-4-2/h3-6H2,1-2H3

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
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:50:06 GMT 2023
Edited
by admin
on Fri Dec 15 17:50:06 GMT 2023
Record UNII
CW590750SQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PROPYL BUTYRATE
FHFI   MI  
Systematic Name English
N-PROPYL BUTANOATE
Common Name English
PROPYL N-BUTYRATE
Common Name English
PROPYL BUTYRATE [MI]
Common Name English
N-PROPANOL BUTYRATE
Common Name English
PROPYL BUTYRATE [FHFI]
Common Name English
BUTANOIC ACID, PROPYL ESTER
Common Name English
FEMA NO. 2934
Code English
PROPYL BUTANOATE
Systematic Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
JECFA EVALUATION PROPYL BUTYRATE
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
Code System Code Type Description
MERCK INDEX
m9229
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY Merck Index
FDA UNII
CW590750SQ
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY
EVMPD
SUB78696
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
203-320-0
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY
PUBCHEM
7770
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID6059318
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY
CAS
105-66-8
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY
CHEBI
89719
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY
SMS_ID
100000138752
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY
JECFA MONOGRAPH
222
Created by admin on Fri Dec 15 17:50:06 GMT 2023 , Edited by admin on Fri Dec 15 17:50:06 GMT 2023
PRIMARY