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1517075-92-1

1517075-92-1 | 4-sulfanylpyridine-3-carbonitrile

CAS No: 1517075-92-1 Catalog No: AG01B55X MDL No:MFCD28127101

Product Description

Catalog Number:
AG01B55X
Chemical Name:
4-sulfanylpyridine-3-carbonitrile
CAS Number:
1517075-92-1
Molecular Formula:
C6H4N2S
Molecular Weight:
136.1744
MDL Number:
MFCD28127101
IUPAC Name:
4-sulfanylidene-1H-pyridine-3-carbonitrile
InChI:
InChI=1S/C6H4N2S/c7-3-5-4-8-2-1-6(5)9/h1-2,4H,(H,8,9)
InChI Key:
WIYHACNEAYWGCM-UHFFFAOYSA-N
SMILES:
N#Cc1cnccc1S

Properties

Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.01g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
136.172g/mol
Monoisotopic Mass:
136.01g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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