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Details

Stereochemistry ACHIRAL
Molecular Formula C9H18O2
Molecular Weight 158.238
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOAMYL ISOBUTYRATE

SMILES

CC(C)CCOC(=O)C(C)C

InChI

InChIKey=VFTGLSWXJMRZNB-UHFFFAOYSA-N
InChI=1S/C9H18O2/c1-7(2)5-6-11-9(10)8(3)4/h7-8H,5-6H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C9H18O2
Molecular Weight 158.238
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:32:58 GMT 2023
Edited
by admin
on Sat Dec 16 18:32:58 GMT 2023
Record UNII
RF0ZT103EG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOAMYL ISOBUTYRATE
FCC  
Systematic Name English
3-METHYLBUTYL ISOBUTYRATE
Systematic Name English
ISOAMYL 2-METHYLPROPANOATE
Systematic Name English
3-METHYLBUTYL 2-METHYLPROPANOATE [FHFI]
Common Name English
3-METHYL-1-BUTYL ISOBUTYRATE
Systematic Name English
ISOBUTYRIC ACID, ISOPENTYL ESTER
Common Name English
PROPANOIC ACID, 2-METHYL-, 3-METHYLBUTYL ESTER
Common Name English
ISOPENTYL ALCOHOL, ISOBUTYRATE
Systematic Name English
ISOAMYL ISOBUTYRATE [FCC]
Common Name English
ISOPENTYL ISOBUTYRATE
Systematic Name English
ISOAMYL ISOBUTANOATE
Systematic Name English
FEMA NO. 3507
Code English
3-METHYLBUTYL 2-METHYLPROPANOATE
FHFI  
Systematic Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Sat Dec 16 18:32:58 GMT 2023 , Edited by admin on Sat Dec 16 18:32:58 GMT 2023
JECFA EVALUATION ISOAMYL ISOBUTYRATE
Created by admin on Sat Dec 16 18:32:58 GMT 2023 , Edited by admin on Sat Dec 16 18:32:58 GMT 2023
Code System Code Type Description
ECHA (EC/EINECS)
218-078-1
Created by admin on Sat Dec 16 18:32:58 GMT 2023 , Edited by admin on Sat Dec 16 18:32:58 GMT 2023
PRIMARY
FDA UNII
RF0ZT103EG
Created by admin on Sat Dec 16 18:32:58 GMT 2023 , Edited by admin on Sat Dec 16 18:32:58 GMT 2023
PRIMARY
CHEBI
87537
Created by admin on Sat Dec 16 18:32:58 GMT 2023 , Edited by admin on Sat Dec 16 18:32:58 GMT 2023
PRIMARY
PUBCHEM
519786
Created by admin on Sat Dec 16 18:32:58 GMT 2023 , Edited by admin on Sat Dec 16 18:32:58 GMT 2023
PRIMARY
CAS
2050-01-3
Created by admin on Sat Dec 16 18:32:58 GMT 2023 , Edited by admin on Sat Dec 16 18:32:58 GMT 2023
PRIMARY
JECFA MONOGRAPH
296
Created by admin on Sat Dec 16 18:32:58 GMT 2023 , Edited by admin on Sat Dec 16 18:32:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID0062131
Created by admin on Sat Dec 16 18:32:58 GMT 2023 , Edited by admin on Sat Dec 16 18:32:58 GMT 2023
PRIMARY