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Details

Stereochemistry ACHIRAL
Molecular Formula C10H14O
Molecular Weight 150.2176
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYLENEISOPHORONE

SMILES

CC1=CC(=O)CC(C)(C)C1=C

InChI

InChIKey=MCGQFKNFKWPWAA-UHFFFAOYSA-N
InChI=1S/C10H14O/c1-7-5-9(11)6-10(3,4)8(7)2/h5H,2,6H2,1,3-4H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2-CYCLOHEXEN-1-ONE, 3,5,5-TRIMETHYL-4-METHYLENE-
Preferred Name English
4-METHYLENEISOPHORONE
Common Name English
3,5,5-TRIMETHYL-4-METHYLENE-1-CYCLOHEXANON-2-ENE
Systematic Name English
4-METHYLENE-3,5,5-TRIMETHYL-2-CYCLOHEXEN-1-ONE
Systematic Name English
METHYLENEISOPHORONE
Common Name English
Code System Code Type Description
PUBCHEM
641351
Created by admin on Wed Apr 02 00:59:55 GMT 2025 , Edited by admin on Wed Apr 02 00:59:55 GMT 2025
PRIMARY
CAS
20548-00-9
Created by admin on Wed Apr 02 00:59:55 GMT 2025 , Edited by admin on Wed Apr 02 00:59:55 GMT 2025
PRIMARY
EPA CompTox
DTXSID10348889
Created by admin on Wed Apr 02 00:59:55 GMT 2025 , Edited by admin on Wed Apr 02 00:59:55 GMT 2025
PRIMARY
FDA UNII
D5MU2X8KSH
Created by admin on Wed Apr 02 00:59:55 GMT 2025 , Edited by admin on Wed Apr 02 00:59:55 GMT 2025
PRIMARY
NIH
NCATS
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