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136364-60-8 | Benzene, 1,2,4-trifluoro-5-(trichloromethyl)-
CAS No: 136364-60-8 Catalog No: AG0011SO MDL No:MFCD09835306
Product Description
Catalog Number:
AG0011SO
Chemical Name:
Benzene, 1,2,4-trifluoro-5-(trichloromethyl)-
CAS Number:
136364-60-8
Molecular Formula:
C7H2Cl3F3
Molecular Weight:
249.4450
MDL Number:
MFCD09835306
IUPAC Name:
1,2,4-trifluoro-5-(trichloromethyl)benzene
InChI:
InChI=1S/C7H2Cl3F3/c8-7(9,10)3-1-5(12)6(13)2-4(3)11/h1-2H
InChI Key:
QCDGLYXARUKIHR-UHFFFAOYSA-N
SMILES:
Fc1cc(c(cc1F)F)C(Cl)(Cl)Cl
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.917g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.438g/mol
Monoisotopic Mass:
247.917g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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