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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 ISOBUTYL 2-METHYLBUTYRATE

SMILES

CCC(C)C(=O)OCC(C)C

InChI

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

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
ISOBUTYL 2-METHYLBUTYRATE
Systematic Name English
2-METHYLPROPYL 2-METHYLBUTYRATE
Systematic Name English
BUTYRIC ACID, 2-METHYL-, ISOBUTYL ESTER
Systematic Name English
ISOBUTYL 2-METHYLBUTYRATE, (±)-
Systematic Name English
ISOBUTYL 2-METHYLBUTANOATE
Systematic Name English
BUTANOIC ACID, 2-METHYL-, 2-METHYLPROPYL ESTER
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
219-492-5
Created by admin on Sat Dec 16 08:13:58 GMT 2023 , Edited by admin on Sat Dec 16 08:13:58 GMT 2023
PRIMARY
CAS
2445-67-2
Created by admin on Sat Dec 16 08:13:58 GMT 2023 , Edited by admin on Sat Dec 16 08:13:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID20862945
Created by admin on Sat Dec 16 08:13:58 GMT 2023 , Edited by admin on Sat Dec 16 08:13:58 GMT 2023
PRIMARY
PUBCHEM
102820
Created by admin on Sat Dec 16 08:13:58 GMT 2023 , Edited by admin on Sat Dec 16 08:13:58 GMT 2023
PRIMARY
FDA UNII
88RJ33L6G3
Created by admin on Sat Dec 16 08:13:58 GMT 2023 , Edited by admin on Sat Dec 16 08:13:58 GMT 2023
PRIMARY
NIH
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