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6940-57-4 | 2-Acetyl-6-methylpyridine
CAS No: 6940-57-4 Catalog No: AG003GB7 MDL No:MFCD06658293
Product Description
Catalog Number:
AG003GB7
Chemical Name:
2-Acetyl-6-methylpyridine
CAS Number:
6940-57-4
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
MDL Number:
MFCD06658293
IUPAC Name:
1-(6-methylpyridin-2-yl)ethanone
InChI:
InChI=1S/C8H9NO/c1-6-4-3-5-8(9-6)7(2)10/h3-5H,1-2H3
InChI Key:
FPQMUQPPAYCAME-UHFFFAOYSA-N
SMILES:
Cc1cccc(n1)C(=O)C
NSC Number:
60153
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.166g/mol
Monoisotopic Mass:
135.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Antineoplastic Activity of New Transition Metal Complexes of 6-Methylpyridine-2-carbaldehyde-N(4)-ethylthiosemicarbazone: X-Ray Crystal Structures of [VO(2)(mpETSC)] and [Pt(mpETSC)Cl]. | Bioinorganic chemistry and applications 20100101 |
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