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334017-98-0 | 5-methylpyridine-2-carbothioamide
CAS No: 334017-98-0 Catalog No: AG00VV93 MDL No:
Product Description
Catalog Number:
AG00VV93
Chemical Name:
5-methylpyridine-2-carbothioamide
CAS Number:
334017-98-0
Molecular Formula:
C7H8N2S
Molecular Weight:
152.2168
IUPAC Name:
5-methylpyridine-2-carbothioamide
InChI:
InChI=1S/C7H8N2S/c1-5-2-3-6(7(8)10)9-4-5/h2-4H,1H3,(H2,8,10)
InChI Key:
BJEVXONLVAPTOY-UHFFFAOYSA-N
SMILES:
Cc1ccc(nc1)C(=S)N
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.041g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.215g/mol
Monoisotopic Mass:
152.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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