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1261875-40-4 | 2,3,6-Trichloro(difluoromethyl)benzene
CAS No: 1261875-40-4 Catalog No: AG01FCLM MDL No:
Product Description
Catalog Number:
AG01FCLM
Chemical Name:
2,3,6-Trichloro(difluoromethyl)benzene
CAS Number:
1261875-40-4
Molecular Formula:
C7H3Cl3F2
Molecular Weight:
231.4545
IUPAC Name:
1,2,4-trichloro-3-(difluoromethyl)benzene
InChI:
InChI=1S/C7H3Cl3F2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2,7H
InChI Key:
LORYSHSKOVYRAK-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1Cl)C(F)F)Cl
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.927g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.448g/mol
Monoisotopic Mass:
229.927g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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