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Home > Pyridines > 114588-82-8
114588-82-8 | 4(1H)-Pyridinethione, 1-(2-propen-1-yl)-
CAS No: 114588-82-8 Catalog No: AG000ER5 MDL No:
Product Description
Catalog Number:
AG000ER5
Chemical Name:
4(1H)-Pyridinethione, 1-(2-propen-1-yl)-
CAS Number:
114588-82-8
Molecular Formula:
C8H9NS
Molecular Weight:
151.2288
IUPAC Name:
1-prop-2-enylpyridine-4-thione
InChI:
InChI=1S/C8H9NS/c1-2-5-9-6-3-8(10)4-7-9/h2-4,6-7H,1,5H2
InChI Key:
RECYKWAQSHMYDY-UHFFFAOYSA-N
SMILES:
C=CCn1ccc(=S)cc1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.046g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.227g/mol
Monoisotopic Mass:
151.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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