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1274677-10-9 | 3-Bromobenzyl-(2,3-dichlorophenyl)ether
CAS No: 1274677-10-9 Catalog No: AG01FCAB MDL No:
Product Description
Catalog Number:
AG01FCAB
Chemical Name:
3-Bromobenzyl-(2,3-dichlorophenyl)ether
CAS Number:
1274677-10-9
Molecular Formula:
C13H9BrCl2O
Molecular Weight:
332.0200
IUPAC Name:
1-[(3-bromophenyl)methoxy]-2,3-dichlorobenzene
InChI:
InChI=1S/C13H9BrCl2O/c14-10-4-1-3-9(7-10)8-17-12-6-2-5-11(15)13(12)16/h1-7H,8H2
InChI Key:
BSGOYLWSDIBPTH-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)COc1cccc(c1Cl)Cl
Properties
Complexity:
240
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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