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Home > Bromides > 1410407-90-7
1410407-90-7 | 3-Bromo-3'-chloro-6'-methoxybenzhydrol
CAS No: 1410407-90-7 Catalog No: AG01FCPT MDL No:
Product Description
Catalog Number:
AG01FCPT
Chemical Name:
3-Bromo-3'-chloro-6'-methoxybenzhydrol
CAS Number:
1410407-90-7
Molecular Formula:
C14H12BrClO2
Molecular Weight:
327.6009
IUPAC Name:
(3-bromophenyl)-(5-chloro-2-methoxyphenyl)methanol
InChI:
InChI=1S/C14H12BrClO2/c1-18-13-6-5-11(16)8-12(13)14(17)9-3-2-4-10(15)7-9/h2-8,14,17H,1H3
InChI Key:
MRAHBGIGOJKXHC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(c1cccc(c1)Br)O)Cl
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.971g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.602g/mol
Monoisotopic Mass:
325.971g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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