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57261-60-6 | 3,4-DIMETHYL-2-PYRIDINECARBONITRILE
CAS No: 57261-60-6 Catalog No: AG01DST7 MDL No:MFCD13176014
Product Description
Catalog Number:
AG01DST7
Chemical Name:
3,4-DIMETHYL-2-PYRIDINECARBONITRILE
CAS Number:
57261-60-6
Molecular Formula:
C8H8N2
Molecular Weight:
132.1625
MDL Number:
MFCD13176014
IUPAC Name:
3,4-dimethylpyridine-2-carbonitrile
InChI:
InChI=1S/C8H8N2/c1-6-3-4-10-8(5-9)7(6)2/h3-4H,1-2H3
InChI Key:
OPNUUWMXUITYNB-UHFFFAOYSA-N
SMILES:
N#Cc1nccc(c1C)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:
132.069g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.166g/mol
Monoisotopic Mass:
132.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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