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Details

Stereochemistry ACHIRAL
Molecular Formula C9H16O2
Molecular Weight 156.2221
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYL-3-BUTENYL BUTANOATE

SMILES

CCCC(=O)OCCC(C)=C

InChI

InChIKey=QXWHISNFDZLFAV-UHFFFAOYSA-N
InChI=1S/C9H16O2/c1-4-5-9(10)11-7-6-8(2)3/h2,4-7H2,1,3H3

HIDE SMILES / InChI

Molecular Formula C9H16O2
Molecular Weight 156.2221
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:57:40 GMT 2023
Edited
by admin
on Sat Dec 16 08:57:40 GMT 2023
Record UNII
E24U5Z23L8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHYL-3-BUTENYL BUTANOATE
Common Name English
BUTANOIC ACID, 3-METHYL-3-BUTENYL ESTER
Systematic Name English
3-METHYLBUT-3-ENYL BUTANOATE
Systematic Name English
3-METHYLBUT-3-EN-1-YL BUTYRATE
Systematic Name English
BUTANOIC ACID, 3-METHYL-3-BUTEN-1-YL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
E24U5Z23L8
Created by admin on Sat Dec 16 08:57:40 GMT 2023 , Edited by admin on Sat Dec 16 08:57:40 GMT 2023
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EPA CompTox
DTXSID00423912
Created by admin on Sat Dec 16 08:57:40 GMT 2023 , Edited by admin on Sat Dec 16 08:57:40 GMT 2023
PRIMARY
CAS
54702-13-5
Created by admin on Sat Dec 16 08:57:40 GMT 2023 , Edited by admin on Sat Dec 16 08:57:40 GMT 2023
PRIMARY
PUBCHEM
6429316
Created by admin on Sat Dec 16 08:57:40 GMT 2023 , Edited by admin on Sat Dec 16 08:57:40 GMT 2023
PRIMARY