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1041604-36-7 | 3-Bromophenyl-(4-chlorobenzyl)ether
CAS No: 1041604-36-7 Catalog No: AG01FDPA MDL No:
Product Description
Catalog Number:
AG01FDPA
Chemical Name:
3-Bromophenyl-(4-chlorobenzyl)ether
CAS Number:
1041604-36-7
Molecular Formula:
C13H10BrClO
Molecular Weight:
297.5749
IUPAC Name:
1-bromo-3-[(4-chlorophenyl)methoxy]benzene
InChI:
InChI=1S/C13H10BrClO/c14-11-2-1-3-13(8-11)16-9-10-4-6-12(15)7-5-10/h1-8H,9H2
InChI Key:
JVHDCFDVDJUXGD-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)COc1cccc(c1)Br
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.96g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.576g/mol
Monoisotopic Mass:
295.96g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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