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116412-84-1 | Methanone, (3-chlorophenyl)(3,4-dimethoxyphenyl)-
CAS No: 116412-84-1 Catalog No: AG000CEZ MDL No:MFCD02127307
Product Description
Catalog Number:
AG000CEZ
Chemical Name:
Methanone, (3-chlorophenyl)(3,4-dimethoxyphenyl)-
CAS Number:
116412-84-1
Molecular Formula:
C15H13ClO3
Molecular Weight:
276.7149
MDL Number:
MFCD02127307
IUPAC Name:
(3-chlorophenyl)-(3,4-dimethoxyphenyl)methanone
InChI:
InChI=1S/C15H13ClO3/c1-18-13-7-6-11(9-14(13)19-2)15(17)10-4-3-5-12(16)8-10/h3-9H,1-2H3
InChI Key:
LJSITUHTWWZKKH-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)C(=O)c1cccc(c1)Cl
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.055g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.716g/mol
Monoisotopic Mass:
276.055g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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