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88949-87-5 | Benzoyl chloride, 4,4'-[methylenebis(oxy)]bis-
CAS No: 88949-87-5 Catalog No: AG0047IR MDL No:
Product Description
Catalog Number:
AG0047IR
Chemical Name:
Benzoyl chloride, 4,4'-[methylenebis(oxy)]bis-
CAS Number:
88949-87-5
Molecular Formula:
C15H10Cl2O4
Molecular Weight:
325.1435
IUPAC Name:
4-[(4-carbonochloridoylphenoxy)methoxy]benzoyl chloride
InChI:
InChI=1S/C15H10Cl2O4/c16-14(18)10-1-5-12(6-2-10)20-9-21-13-7-3-11(4-8-13)15(17)19/h1-8H,9H2
InChI Key:
MMAGTRDRMILLTM-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(cc1)OCOc1ccc(cc1)C(=O)Cl
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.996g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.141g/mol
Monoisotopic Mass:
323.996g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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