U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C16H9Cl2F3
Molecular Weight 329.144
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-DICHLORO-9-METHYL-6-(TRIFLUOROMETHYL)PHENANTHRENE

SMILES

CC1=CC2=C(Cl)C=C(Cl)C=C2C3=C1C=CC(=C3)C(F)(F)F

InChI

InChIKey=BDHXSUNSZPJEMF-UHFFFAOYSA-N
InChI=1S/C16H9Cl2F3/c1-8-4-14-13(6-10(17)7-15(14)18)12-5-9(16(19,20)21)2-3-11(8)12/h2-7H,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
1,3-DICHLORO-9-METHYL-6-(TRIFLUOROMETHYL)PHENANTHRENE
Preferred Name English
Code System Code Type Description
PUBCHEM
3023645
Created by admin on Tue Apr 01 19:10:57 GMT 2025 , Edited by admin on Tue Apr 01 19:10:57 GMT 2025
PRIMARY
ECHA (EC/EINECS)
302-728-7
Created by admin on Tue Apr 01 19:10:57 GMT 2025 , Edited by admin on Tue Apr 01 19:10:57 GMT 2025
PRIMARY
FDA UNII
V2WW3FMN9P
Created by admin on Tue Apr 01 19:10:57 GMT 2025 , Edited by admin on Tue Apr 01 19:10:57 GMT 2025
PRIMARY
CAS
94133-66-1
Created by admin on Tue Apr 01 19:10:57 GMT 2025 , Edited by admin on Tue Apr 01 19:10:57 GMT 2025
PRIMARY
EPA CompTox
DTXSID90240675
Created by admin on Tue Apr 01 19:10:57 GMT 2025 , Edited by admin on Tue Apr 01 19:10:57 GMT 2025
PRIMARY