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Home > Bromides > 1309932-98-6
1309932-98-6 | 2-Bromobenzyl-(3,5-dichlorophenyl)ether
CAS No: 1309932-98-6 Catalog No: AG01FCAY MDL No:
Product Description
Catalog Number:
AG01FCAY
Chemical Name:
2-Bromobenzyl-(3,5-dichlorophenyl)ether
CAS Number:
1309932-98-6
Molecular Formula:
C13H9BrCl2O
Molecular Weight:
332.0200
IUPAC Name:
1-[(2-bromophenyl)methoxy]-3,5-dichlorobenzene
InChI:
InChI=1S/C13H9BrCl2O/c14-13-4-2-1-3-9(13)8-17-12-6-10(15)5-11(16)7-12/h1-7H,8H2
InChI Key:
AUKYUFOIVYUHHF-UHFFFAOYSA-N
SMILES:
Clc1cc(OCc2ccccc2Br)cc(c1)Cl
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.921g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.018g/mol
Monoisotopic Mass:
329.921g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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