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Details

Stereochemistry ACHIRAL
Molecular Formula C9H16O2
Molecular Weight 156.2221
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BUTYL (2E)-2-METHYLBUT-2-ENOATE

SMILES

CCCCOC(=O)C(\C)=C\C

InChI

InChIKey=RBGFLIOXJWFKKX-VMPITWQZSA-N
InChI=1S/C9H16O2/c1-4-6-7-11-9(10)8(3)5-2/h5H,4,6-7H2,1-3H3/b8-5+

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 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:17:16 GMT 2023
Edited
by admin
on Sat Dec 16 09:17:16 GMT 2023
Record UNII
7VD4CT8NDW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTYL (2E)-2-METHYLBUT-2-ENOATE
Systematic Name English
2-BUTENOIC ACID, 2-METHYL-, BUTYL ESTER, (2E)-
Systematic Name English
TIGLIC ACID N-BUTYL ESTER
Common Name English
N-BUTYL TIGLATE
Common Name English
BUTYL .ALPHA.-METHYLCROTONATE
Systematic Name English
TIGLIC ACID, BUTYL ESTER
Common Name English
N-BUTYLTIGLATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID7052527
Created by admin on Sat Dec 16 09:17:16 GMT 2023 , Edited by admin on Sat Dec 16 09:17:16 GMT 2023
PRIMARY
ECHA (EC/EINECS)
232-086-2
Created by admin on Sat Dec 16 09:17:16 GMT 2023 , Edited by admin on Sat Dec 16 09:17:16 GMT 2023
PRIMARY
FDA UNII
7VD4CT8NDW
Created by admin on Sat Dec 16 09:17:16 GMT 2023 , Edited by admin on Sat Dec 16 09:17:16 GMT 2023
PRIMARY
PUBCHEM
5352450
Created by admin on Sat Dec 16 09:17:16 GMT 2023 , Edited by admin on Sat Dec 16 09:17:16 GMT 2023
PRIMARY
CAS
7785-66-2
Created by admin on Sat Dec 16 09:17:16 GMT 2023 , Edited by admin on Sat Dec 16 09:17:16 GMT 2023
PRIMARY
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