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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H9Cl3O2
Molecular Weight 267.536
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,4,4-Trichloro-3-hydroxy-1-phenyl-1-butanone, (3R)-

SMILES

O[C@H](CC(=O)C1=CC=CC=C1)C(Cl)(Cl)Cl

InChI

InChIKey=JTJFOKGHNOVCTC-SECBINFHSA-N
InChI=1S/C10H9Cl3O2/c11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7/h1-5,9,15H,6H2/t9-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
4,4,4-Trichloro-3-hydroxy-1-phenyl-1-butanone, (3R)-
Systematic Name English
(3R)-4,4,4-Trichloro-3-hydroxy-1-phenyl-1-butanone
Preferred Name English
1-Butanone, 4,4,4-trichloro-3-hydroxy-1-phenyl-, (3R)-
Systematic Name English
1-Butanone, 4,4,4-trichloro-3-hydroxy-1-phenyl-, (R)-
Systematic Name English
Code System Code Type Description
CAS
196107-42-3
Created by admin on Wed Apr 02 20:07:03 GMT 2025 , Edited by admin on Wed Apr 02 20:07:03 GMT 2025
PRIMARY
FDA UNII
QU936RG97P
Created by admin on Wed Apr 02 20:07:03 GMT 2025 , Edited by admin on Wed Apr 02 20:07:03 GMT 2025
PRIMARY
PUBCHEM
786497
Created by admin on Wed Apr 02 20:07:03 GMT 2025 , Edited by admin on Wed Apr 02 20:07:03 GMT 2025
PRIMARY
NIH
NCATS
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