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134446-26-7 | 4-Bromo-3'-methoxybenzhydrol
CAS No: 134446-26-7 Catalog No: AG01FFAI MDL No:
Product Description
Catalog Number:
AG01FFAI
Chemical Name:
4-Bromo-3'-methoxybenzhydrol
CAS Number:
134446-26-7
Molecular Formula:
C14H13BrO2
Molecular Weight:
293.1558
IUPAC Name:
(4-bromophenyl)-(3-methoxyphenyl)methanol
InChI:
InChI=1S/C14H13BrO2/c1-17-13-4-2-3-11(9-13)14(16)10-5-7-12(15)8-6-10/h2-9,14,16H,1H3
InChI Key:
RUJMKPWOXLACAZ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C(c1ccc(cc1)Br)O
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.01g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.16g/mol
Monoisotopic Mass:
292.01g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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