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116412-97-6 | Methanone, (3,5-dichlorophenyl)(3,4-dimethoxyphenyl)-
CAS No: 116412-97-6 Catalog No: AG000CG4 MDL No:
Product Description
Catalog Number:
AG000CG4
Chemical Name:
Methanone, (3,5-dichlorophenyl)(3,4-dimethoxyphenyl)-
CAS Number:
116412-97-6
Molecular Formula:
C15H12Cl2O3
Molecular Weight:
311.1600
IUPAC Name:
(3,5-dichlorophenyl)-(3,4-dimethoxyphenyl)methanone
InChI:
InChI=1S/C15H12Cl2O3/c1-19-13-4-3-9(7-14(13)20-2)15(18)10-5-11(16)8-12(17)6-10/h3-8H,1-2H3
InChI Key:
UNJUJIMIVAHKLM-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)C(=O)c1cc(Cl)cc(c1)Cl
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.016g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.158g/mol
Monoisotopic Mass:
310.016g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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