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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H16O2
Molecular Weight 144.2114
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTYL ISOBUTYRATE

SMILES

CCCCOC(=O)C(C)C

InChI

InChIKey=JSLCOZYBKYHZNL-UHFFFAOYSA-N
InChI=1S/C8H16O2/c1-4-5-6-10-8(9)7(2)3/h7H,4-6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C8H16O2
Molecular Weight 144.2114
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Differential attraction of malaria mosquitoes to volatile blends produced by human skin bacteria.
2010 Dec 30
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:41:45 GMT 2023
Edited
by admin
on Fri Dec 15 16:41:45 GMT 2023
Record UNII
PW9UJ5C0F3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTYL ISOBUTYRATE
FCC   FHFI  
Systematic Name English
BUTYL ISOBUTYRATE [FCC]
Common Name English
BUTYL ISOBUTYRATE [FHFI]
Common Name English
ISOBUTYRIC ACID, BUTYL ESTER
Common Name English
PROPANOIC ACID, 2-METHYL-, BUTYL ESTER
Common Name English
FEMA NO. 2188
Code English
Classification Tree Code System Code
JECFA EVALUATION BUTYL ISOBUTYRATE
Created by admin on Fri Dec 15 16:41:45 GMT 2023 , Edited by admin on Fri Dec 15 16:41:45 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 16:41:45 GMT 2023 , Edited by admin on Fri Dec 15 16:41:45 GMT 2023
Code System Code Type Description
JECFA MONOGRAPH
207
Created by admin on Fri Dec 15 16:41:45 GMT 2023 , Edited by admin on Fri Dec 15 16:41:45 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-614-6
Created by admin on Fri Dec 15 16:41:45 GMT 2023 , Edited by admin on Fri Dec 15 16:41:45 GMT 2023
PRIMARY
EPA CompTox
DTXSID9073888
Created by admin on Fri Dec 15 16:41:45 GMT 2023 , Edited by admin on Fri Dec 15 16:41:45 GMT 2023
PRIMARY
CAS
97-87-0
Created by admin on Fri Dec 15 16:41:45 GMT 2023 , Edited by admin on Fri Dec 15 16:41:45 GMT 2023
PRIMARY
PUBCHEM
7353
Created by admin on Fri Dec 15 16:41:45 GMT 2023 , Edited by admin on Fri Dec 15 16:41:45 GMT 2023
PRIMARY
FDA UNII
PW9UJ5C0F3
Created by admin on Fri Dec 15 16:41:45 GMT 2023 , Edited by admin on Fri Dec 15 16:41:45 GMT 2023
PRIMARY