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Details

Stereochemistry ACHIRAL
Molecular Formula C7H12O2
Molecular Weight 128.169
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2,4-DIMETHYL-2-PENTENOIC ACID, (2E)-

SMILES

CC(C)\C=C(/C)C(O)=O

InChI

InChIKey=DMHLGGQHOSTMJG-GQCTYLIASA-N
InChI=1S/C7H12O2/c1-5(2)4-6(3)7(8)9/h4-5H,1-3H3,(H,8,9)/b6-4+

HIDE SMILES / InChI

Molecular Formula C7H12O2
Molecular Weight 128.169
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 Fri Dec 15 19:39:07 GMT 2023
Edited
by admin
on Fri Dec 15 19:39:07 GMT 2023
Record UNII
KI18C46DHR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,4-DIMETHYL-2-PENTENOIC ACID, (2E)-
Common Name English
2-PENTENOIC ACID, 2,4-DIMETHYL-, (E)-
Common Name English
FEMA NO. 3143, 2E-
Code English
2-PENTENOIC ACID, 2,4-DIMETHYL-, (2E)-
Common Name English
(E)-2,4-DIMETHYL-2-PENTENOYL CHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
KI18C46DHR
Created by admin on Fri Dec 15 19:39:07 GMT 2023 , Edited by admin on Fri Dec 15 19:39:07 GMT 2023
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PUBCHEM
5362565
Created by admin on Fri Dec 15 19:39:07 GMT 2023 , Edited by admin on Fri Dec 15 19:39:07 GMT 2023
PRIMARY
EPA CompTox
DTXSID60192036
Created by admin on Fri Dec 15 19:39:07 GMT 2023 , Edited by admin on Fri Dec 15 19:39:07 GMT 2023
PRIMARY
CAS
3876-52-6
Created by admin on Fri Dec 15 19:39:07 GMT 2023 , Edited by admin on Fri Dec 15 19:39:07 GMT 2023
PRIMARY