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Home > Bromides > 1093865-36-1
1093865-36-1 | 3-Bromo-3'-chlorobenzhydrol
CAS No: 1093865-36-1 Catalog No: AG01FFCO MDL No:
Product Description
Catalog Number:
AG01FFCO
Chemical Name:
3-Bromo-3'-chlorobenzhydrol
CAS Number:
1093865-36-1
Molecular Formula:
C13H10BrClO
Molecular Weight:
297.5749
IUPAC Name:
(3-bromophenyl)-(3-chlorophenyl)methanol
InChI:
InChI=1S/C13H10BrClO/c14-11-5-1-3-9(7-11)13(16)10-4-2-6-12(15)8-10/h1-8,13,16H
InChI Key:
OYAXBKJQKAGKPW-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)C(c1cccc(c1)Br)O
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.96g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.576g/mol
Monoisotopic Mass:
295.96g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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