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1443332-22-6 | 3-Bromo-3',5'-dichlorobenzhydrol
CAS No: 1443332-22-6 Catalog No: AG01FEPY MDL No:
Product Description
Catalog Number:
AG01FEPY
Chemical Name:
3-Bromo-3',5'-dichlorobenzhydrol
CAS Number:
1443332-22-6
Molecular Formula:
C13H9BrCl2O
Molecular Weight:
332.0200
IUPAC Name:
(3-bromophenyl)-(3,5-dichlorophenyl)methanol
InChI:
InChI=1S/C13H9BrCl2O/c14-10-3-1-2-8(4-10)13(17)9-5-11(15)7-12(16)6-9/h1-7,13,17H
InChI Key:
BQBGQMAXAMYKGD-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C(c1cc(Cl)cc(c1)Cl)O
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.921g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
332.018g/mol
Monoisotopic Mass:
329.921g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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