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Home > Pyridines > 625826-72-4
625826-72-4 | 2-Pyridinecarbonitrile, 3-[(1-methylethyl)thio]-
CAS No: 625826-72-4 Catalog No: AG00EL97 MDL No:
Product Description
Catalog Number:
AG00EL97
Chemical Name:
2-Pyridinecarbonitrile, 3-[(1-methylethyl)thio]-
CAS Number:
625826-72-4
IUPAC Name:
3-propan-2-ylsulfanylpyridine-2-carbonitrile
InChI:
InChI=1S/C9H10N2S/c1-7(2)12-9-4-3-5-11-8(9)6-10/h3-5,7H,1-2H3
InChI Key:
ZMCMMJSKPRBHBA-UHFFFAOYSA-N
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.056g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.253g/mol
Monoisotopic Mass:
178.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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