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88950-07-6

88950-07-6 | Ethanone, 1,1'-[methylenebis(oxy-4,1-phenylene)]bis[2-bromo-

CAS No: 88950-07-6 Catalog No: AG0047IL MDL No:

Product Description

Catalog Number:
AG0047IL
Chemical Name:
Ethanone, 1,1'-[methylenebis(oxy-4,1-phenylene)]bis[2-bromo-
CAS Number:
88950-07-6
Molecular Formula:
C17H14Br2O4
Molecular Weight:
442.0987
IUPAC Name:
2-bromo-1-[4-[[4-(2-bromoacetyl)phenoxy]methoxy]phenyl]ethanone
InChI:
InChI=1S/C17H14Br2O4/c18-9-16(20)12-1-5-14(6-2-12)22-11-23-15-7-3-13(4-8-15)17(21)10-19/h1-8H,9-11H2
InChI Key:
CCTNCMTWDWEDOC-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1ccc(cc1)OCOc1ccc(cc1)C(=O)CBr

Properties

Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
441.924g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
442.103g/mol
Monoisotopic Mass:
439.926g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

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