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59576-31-7 | Ethanone, 1-(4,6-dimethyl-2-pyridinyl)- (9CI)
CAS No: 59576-31-7 Catalog No: AG00EIG3 MDL No:MFCD07367303
Product Description
Catalog Number:
AG00EIG3
Chemical Name:
Ethanone, 1-(4,6-dimethyl-2-pyridinyl)- (9CI)
CAS Number:
59576-31-7
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
MDL Number:
MFCD07367303
IUPAC Name:
1-(4,6-dimethylpyridin-2-yl)ethanone
InChI:
InChI=1S/C9H11NO/c1-6-4-7(2)10-9(5-6)8(3)11/h4-5H,1-3H3
InChI Key:
IWZFETYQIYPLIE-UHFFFAOYSA-N
SMILES:
Cc1cc(C)nc(c1)C(=O)C
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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