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Home > Pyridines > 1379034-62-4
1379034-62-4 | 3-Pyridinecarbonitrile, 5-methoxy-4-methyl-
CAS No: 1379034-62-4 Catalog No: AG00142V MDL No:MFCD18905272
Product Description
Catalog Number:
AG00142V
Chemical Name:
3-Pyridinecarbonitrile, 5-methoxy-4-methyl-
CAS Number:
1379034-62-4
Molecular Formula:
C8H8N2O
Molecular Weight:
148.1619
MDL Number:
MFCD18905272
IUPAC Name:
5-methoxy-4-methylpyridine-3-carbonitrile
InChI:
InChI=1S/C8H8N2O/c1-6-7(3-9)4-10-5-8(6)11-2/h4-5H,1-2H3
InChI Key:
RDICMIFYFGSXEE-UHFFFAOYSA-N
SMILES:
COc1cncc(c1C)C#N
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.064g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.165g/mol
Monoisotopic Mass:
148.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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