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Details

Stereochemistry ACHIRAL
Molecular Formula C16H14O
Molecular Weight 222.2818
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYLCHALCONE

SMILES

CC1=CC=C(\C=C\C(=O)C2=CC=CC=C2)C=C1

InChI

InChIKey=XNLFHCPVTULKIV-VAWYXSNFSA-N
InChI=1S/C16H14O/c1-13-7-9-14(10-8-13)11-12-16(17)15-5-3-2-4-6-15/h2-12H,1H3/b12-11+

HIDE SMILES / InChI

Molecular Formula C16H14O
Molecular Weight 222.2818
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 Tue Apr 01 19:35:00 GMT 2025
Edited
by admin
on Tue Apr 01 19:35:00 GMT 2025
Record UNII
4V69F7BQ45
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-39793
Preferred Name English
4-METHYLCHALCONE
Systematic Name English
2-PROPEN-1-ONE, 3-(4-METHYLPHENYL)-1-PHENYL-, (2E)-
Systematic Name English
(E)-1-PHENYL-3-(4-TOLYL)-2-PROPEN-1-ONE
Systematic Name English
(4-METHYLBENZYLIDENE)ACETOPHENONE
Systematic Name English
CHALCONE, 4-METHYL-
Systematic Name English
(2E)-3-(4-METHYLPHENYL)-1-PHENYL-2-PROPENONE
Systematic Name English
TRANS-4-METHYLCHALCONE
Systematic Name English
METHYLCHALCONE
Systematic Name English
1-PHENYL-3-(4-METHYLPHENYL)-2-PROPEN-1-ONE
Systematic Name English
3-(4-METHYLPHENYL)-1-PHENYL-2-PROPEN-1-ONE
Systematic Name English
PHENYL P-METHYLSTYRYL KETONE
Common Name English
2-PROPEN-1-ONE, 3-(4-METHYLPHENYL)-1-PHENYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
5375849
Created by admin on Tue Apr 01 19:35:00 GMT 2025 , Edited by admin on Tue Apr 01 19:35:00 GMT 2025
PRIMARY
CAS
4224-87-7
Created by admin on Tue Apr 01 19:35:00 GMT 2025 , Edited by admin on Tue Apr 01 19:35:00 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
CAS
22252-14-8
Created by admin on Tue Apr 01 19:35:00 GMT 2025 , Edited by admin on Tue Apr 01 19:35:00 GMT 2025
PRIMARY
EPA CompTox
DTXSID701316716
Created by admin on Tue Apr 01 19:35:00 GMT 2025 , Edited by admin on Tue Apr 01 19:35:00 GMT 2025
PRIMARY
NSC
39793
Created by admin on Tue Apr 01 19:35:00 GMT 2025 , Edited by admin on Tue Apr 01 19:35:00 GMT 2025
PRIMARY
FDA UNII
4V69F7BQ45
Created by admin on Tue Apr 01 19:35:00 GMT 2025 , Edited by admin on Tue Apr 01 19:35:00 GMT 2025
PRIMARY