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Home > Bromides > 1443345-13-8
1443345-13-8 | 2-Bromo-3'-chloro-5'-fluorobenzhydrol
CAS No: 1443345-13-8 Catalog No: AG01FD6T MDL No:
Product Description
Catalog Number:
AG01FD6T
Chemical Name:
2-Bromo-3'-chloro-5'-fluorobenzhydrol
CAS Number:
1443345-13-8
Molecular Formula:
C13H9BrClFO
Molecular Weight:
315.5654
IUPAC Name:
(2-bromophenyl)-(3-chloro-5-fluorophenyl)methanol
InChI:
InChI=1S/C13H9BrClFO/c14-12-4-2-1-3-11(12)13(17)8-5-9(15)7-10(16)6-8/h1-7,13,17H
InChI Key:
RILBPESELJVUDJ-UHFFFAOYSA-N
SMILES:
Fc1cc(Cl)cc(c1)C(c1ccccc1Br)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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