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Details

Stereochemistry ACHIRAL
Molecular Formula C6H10O2
Molecular Weight 114.1424
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Methyl tiglate

SMILES

COC(=O)C(\C)=C\C

InChI

InChIKey=YYJWBYNQJLBIGS-SNAWJCMRSA-N
InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h4H,1-3H3/b5-4+

HIDE SMILES / InChI

Molecular Formula C6H10O2
Molecular Weight 114.1424
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 Mon Mar 31 22:24:06 GMT 2025
Edited
by admin
on Mon Mar 31 22:24:06 GMT 2025
Record UNII
7B33DP4YUM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-55277
Preferred Name English
Methyl tiglate
Systematic Name English
2-Butenoic acid, 2-methyl-, methyl ester
Systematic Name English
Methyl 2-methylcrotonate
Systematic Name English
Methyl 2-methyl-2-butenoate
Systematic Name English
2-Butenoic acid, 2-methyl-, methyl ester, (2E)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
229-575-8
Created by admin on Mon Mar 31 22:24:06 GMT 2025 , Edited by admin on Mon Mar 31 22:24:06 GMT 2025
PRIMARY
CAS
41725-90-0
Created by admin on Mon Mar 31 22:24:06 GMT 2025 , Edited by admin on Mon Mar 31 22:24:06 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID30878830
Created by admin on Mon Mar 31 22:24:06 GMT 2025 , Edited by admin on Mon Mar 31 22:24:06 GMT 2025
PRIMARY
NSC
55277
Created by admin on Mon Mar 31 22:24:06 GMT 2025 , Edited by admin on Mon Mar 31 22:24:06 GMT 2025
PRIMARY
PUBCHEM
5323652
Created by admin on Mon Mar 31 22:24:06 GMT 2025 , Edited by admin on Mon Mar 31 22:24:06 GMT 2025
PRIMARY
CAS
6622-76-0
Created by admin on Mon Mar 31 22:24:06 GMT 2025 , Edited by admin on Mon Mar 31 22:24:06 GMT 2025
PRIMARY
FDA UNII
7B33DP4YUM
Created by admin on Mon Mar 31 22:24:06 GMT 2025 , Edited by admin on Mon Mar 31 22:24:06 GMT 2025
PRIMARY