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60081-02-9

60081-02-9 | 2-Bromo-3'-fluorobenzhydrol

CAS No: 60081-02-9 Catalog No: AG01EWLV MDL No:

Product Description

Catalog Number:
AG01EWLV
Chemical Name:
2-Bromo-3'-fluorobenzhydrol
CAS Number:
60081-02-9
Molecular Formula:
C13H10BrFO
Molecular Weight:
281.1203
IUPAC Name:
(2-bromophenyl)-(3-fluorophenyl)methanol
InChI:
InChI=1S/C13H10BrFO/c14-12-7-2-1-6-11(12)13(16)9-4-3-5-10(15)8-9/h1-8,13,16H
InChI Key:
FNOLIQBFMNUMST-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(c1ccccc1Br)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:
279.99g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.124g/mol
Monoisotopic Mass:
279.99g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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