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1640-73-9

1640-73-9 | Methanethioamide, N-2-pyridinyl-

CAS No: 1640-73-9 Catalog No: AG001UL1 MDL No:

Product Description

Catalog Number:
AG001UL1
Chemical Name:
Methanethioamide, N-2-pyridinyl-
CAS Number:
1640-73-9
Molecular Formula:
C6H6N2S
Molecular Weight:
138.1902
IUPAC Name:
N-pyridin-2-ylmethanethioamide
InChI:
InChI=1S/C6H6N2S/c9-5-8-6-3-1-2-4-7-6/h1-5H,(H,7,8,9)
InChI Key:
DXPZJOOTAPNPFF-UHFFFAOYSA-N
SMILES:
S=CNc1ccccn1

Properties

Complexity:
95.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.025g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
138.188g/mol
Monoisotopic Mass:
138.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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