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147217-72-9 | Benzene, 1-bromo-2-(3-bromophenoxy)-
CAS No: 147217-72-9 Catalog No: AG001EPE MDL No:
Product Description
Catalog Number:
AG001EPE
Chemical Name:
Benzene, 1-bromo-2-(3-bromophenoxy)-
CAS Number:
147217-72-9
Molecular Formula:
C12H8Br2O
Molecular Weight:
327.9993
IUPAC Name:
1-bromo-2-(3-bromophenoxy)benzene
InChI:
InChI=1S/C12H8Br2O/c13-9-4-3-5-10(8-9)15-12-7-2-1-6-11(12)14/h1-8H
InChI Key:
GODQTPRKFHOLPH-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)Oc1ccccc1Br
UNII:
17U26ZWT64
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.892g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.003g/mol
Monoisotopic Mass:
325.894g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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