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Home > Bromides > 1443351-39-0
1443351-39-0 | 2-Bromo-4'-chloro-3'-fluorobenzhydrol
CAS No: 1443351-39-0 Catalog No: AG01FD7F MDL No:
Product Description
Catalog Number:
AG01FD7F
Chemical Name:
2-Bromo-4'-chloro-3'-fluorobenzhydrol
CAS Number:
1443351-39-0
Molecular Formula:
C13H9BrClFO
Molecular Weight:
315.5654
IUPAC Name:
(2-bromophenyl)-(4-chloro-3-fluorophenyl)methanol
InChI:
InChI=1S/C13H9BrClFO/c14-10-4-2-1-3-9(10)13(17)8-5-6-11(15)12(16)7-8/h1-7,13,17H
InChI Key:
PEDMLGKCJFWVSF-UHFFFAOYSA-N
SMILES:
Brc1ccccc1C(c1ccc(c(c1)F)Cl)O
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.951g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
315.566g/mol
Monoisotopic Mass:
313.951g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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