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29059-12-9 | Methanone, (dimethylphenyl)(methylphenyl)- (9CI)
CAS No: 29059-12-9 Catalog No: AG002X7Q MDL No:
Product Description
Catalog Number:
AG002X7Q
Chemical Name:
Methanone, (dimethylphenyl)(methylphenyl)- (9CI)
CAS Number:
29059-12-9
Molecular Formula:
C16H16O
Molecular Weight:
224.2976
IUPAC Name:
(2,3-dimethylphenyl)-(2-methylphenyl)methanone
InChI:
InChI=1S/C16H16O/c1-11-8-6-10-15(13(11)3)16(17)14-9-5-4-7-12(14)2/h4-10H,1-3H3
InChI Key:
JONATIYWVQVCAI-UHFFFAOYSA-N
SMILES:
Cc1ccccc1C(=O)c1cccc(c1C)C
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.12g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.303g/mol
Monoisotopic Mass:
224.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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