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Details

Stereochemistry RACEMIC
Molecular Formula C9H18O2
Molecular Weight 158.238
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-PENTYL BUTYRATE

SMILES

CCCC(C)OC(=O)CCC

InChI

InChIKey=DJOCFLQKCMWABC-UHFFFAOYSA-N
InChI=1S/C9H18O2/c1-4-6-8(3)11-9(10)7-5-2/h8H,4-7H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
2-PENTYL BUTYRATE
FHFI  
Systematic Name English
1-METHYLBUTYL BUTANOATE
Systematic Name English
2-PENTYL BUTANOATE
Systematic Name English
2-PENTYL BUTYRATE [FHFI]
Common Name English
FEMA NO. 3893
Code English
BUTANOIC ACID, 1-METHYLBUTYL ESTER
Common Name English
Classification Tree Code System Code
JECFA EVALUATION 2-PENTYL BUTYRATE
Created by admin on Fri Dec 15 21:48:48 GMT 2023 , Edited by admin on Fri Dec 15 21:48:48 GMT 2023
Code System Code Type Description
JECFA MONOGRAPH
1074
Created by admin on Fri Dec 15 21:48:48 GMT 2023 , Edited by admin on Fri Dec 15 21:48:48 GMT 2023
PRIMARY
CAS
60415-61-4
Created by admin on Fri Dec 15 21:48:48 GMT 2023 , Edited by admin on Fri Dec 15 21:48:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
262-226-8
Created by admin on Fri Dec 15 21:48:48 GMT 2023 , Edited by admin on Fri Dec 15 21:48:48 GMT 2023
PRIMARY
FDA UNII
O5709B244U
Created by admin on Fri Dec 15 21:48:48 GMT 2023 , Edited by admin on Fri Dec 15 21:48:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID50866810
Created by admin on Fri Dec 15 21:48:48 GMT 2023 , Edited by admin on Fri Dec 15 21:48:48 GMT 2023
PRIMARY
PUBCHEM
43263
Created by admin on Fri Dec 15 21:48:48 GMT 2023 , Edited by admin on Fri Dec 15 21:48:48 GMT 2023
PRIMARY