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128924-01-6 | Benzene, 1,3-dibromo-5-(phenylmethoxy)-
CAS No: 128924-01-6 Catalog No: AG000YK8 MDL No:MFCD17011975
Product Description
Catalog Number:
AG000YK8
Chemical Name:
Benzene, 1,3-dibromo-5-(phenylmethoxy)-
CAS Number:
128924-01-6
Molecular Formula:
C13H10Br2O
Molecular Weight:
342.0259
MDL Number:
MFCD17011975
IUPAC Name:
1,3-dibromo-5-phenylmethoxybenzene
InChI:
InChI=1S/C13H10Br2O/c14-11-6-12(15)8-13(7-11)16-9-10-4-2-1-3-5-10/h1-8H,9H2
InChI Key:
CROMNVSVLZKBEF-UHFFFAOYSA-N
SMILES:
Brc1cc(OCc2ccccc2)cc(c1)Br
Properties
Complexity:
194
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:
5.2
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