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1027512-72-6 | 3-Chloro-2,5-dibromobenzotrifluoride
CAS No: 1027512-72-6 Catalog No: AG01F39B MDL No:MFCD09800700
Product Description
Catalog Number:
AG01F39B
Chemical Name:
3-Chloro-2,5-dibromobenzotrifluoride
CAS Number:
1027512-72-6
Molecular Formula:
C7H2Br2ClF3
Molecular Weight:
338.3470
MDL Number:
MFCD09800700
IUPAC Name:
2,5-dibromo-1-chloro-3-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2Br2ClF3/c8-3-1-4(7(11,12)13)6(9)5(10)2-3/h1-2H
InChI Key:
LRAHWXYALPXVCG-UHFFFAOYSA-N
SMILES:
Brc1cc(Cl)c(c(c1)C(F)(F)F)Br
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.814g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.346g/mol
Monoisotopic Mass:
335.816g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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