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59576-24-8 | 2-(3-METHYLBENZOYL)PYRIDINE
CAS No: 59576-24-8 Catalog No: AG00EEL1 MDL No:MFCD07699226
Product Description
Catalog Number:
AG00EEL1
Chemical Name:
2-(3-METHYLBENZOYL)PYRIDINE
CAS Number:
59576-24-8
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
MDL Number:
MFCD07699226
IUPAC Name:
(3-methylphenyl)-pyridin-2-ylmethanone
InChI:
InChI=1S/C13H11NO/c1-10-5-4-6-11(9-10)13(15)12-7-2-3-8-14-12/h2-9H,1H3
InChI Key:
GEPRZBNXNHEPSJ-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C(=O)c1ccccn1
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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