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146774-80-3 | Benzenecarboximidoyl chloride, 4-bromo-N-[2-(2,2,2-trichloroacetyl)phenyl]-
CAS No: 146774-80-3 Catalog No: AG001EB0 MDL No:
Product Description
Catalog Number:
AG001EB0
Chemical Name:
Benzenecarboximidoyl chloride, 4-bromo-N-[2-(2,2,2-trichloroacetyl)phenyl]-
CAS Number:
146774-80-3
Molecular Formula:
C15H8BrCl4NO
Molecular Weight:
439.9461
IUPAC Name:
4-bromo-N-[2-(2,2,2-trichloroacetyl)phenyl]benzenecarboximidoyl chloride
InChI:
InChI=1S/C15H8BrCl4NO/c16-10-7-5-9(6-8-10)14(17)21-12-4-2-1-3-11(12)13(22)15(18,19)20/h1-8H
InChI Key:
QGSVGWJAXVYOTD-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C(=Nc1ccccc1C(=O)C(Cl)(Cl)Cl)Cl
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.851g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
439.939g/mol
Monoisotopic Mass:
436.854g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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