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Home > Bromides > 1017261-83-4
1017261-83-4 | Benzene, 1,4-dibromo-2-(phenylmethoxy)-
CAS No: 1017261-83-4 Catalog No: AG0005BK MDL No:MFCD18447599
Product Description
Catalog Number:
AG0005BK
Chemical Name:
Benzene, 1,4-dibromo-2-(phenylmethoxy)-
CAS Number:
1017261-83-4
Molecular Formula:
C13H10Br2O
Molecular Weight:
342.0259
MDL Number:
MFCD18447599
IUPAC Name:
1,4-dibromo-2-phenylmethoxybenzene
InChI:
InChI=1S/C13H10Br2O/c14-11-6-7-12(15)13(8-11)16-9-10-4-2-1-3-5-10/h1-8H,9H2
InChI Key:
MYBIFYIKNYMRPK-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)OCc1ccccc1)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:
341.908g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.03g/mol
Monoisotopic Mass:
339.91g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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