200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 127627-22-9
127627-22-9 | 1H-Benzimidazole-2-carbothioic acid, hydrazide
CAS No: 127627-22-9 Catalog No: AG000X85 MDL No:
Product Description
Catalog Number:
AG000X85
Chemical Name:
1H-Benzimidazole-2-carbothioic acid, hydrazide
CAS Number:
127627-22-9
Molecular Formula:
C8H8N4S
Molecular Weight:
192.2409
IUPAC Name:
1H-benzimidazole-2-carbothiohydrazide
InChI:
InChI=1S/C8H8N4S/c9-12-8(13)7-10-5-3-1-2-4-6(5)11-7/h1-4H,9H2,(H,10,11)(H,12,13)
InChI Key:
IQWLRILBTJJSTP-UHFFFAOYSA-N
SMILES:
NNC(=S)c1nc2c([nH]1)cccc2
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.047g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
192.24g/mol
Monoisotopic Mass:
192.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
98.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.