200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 874788-60-0
874788-60-0 | 1H-Tetrazole-5-thiol, 4,5-dihydro-1-hydroxy-4-phenyl-
CAS No: 874788-60-0 Catalog No: AG004EPC MDL No:
Product Description
Catalog Number:
AG004EPC
Chemical Name:
1H-Tetrazole-5-thiol, 4,5-dihydro-1-hydroxy-4-phenyl-
CAS Number:
874788-60-0
Molecular Formula:
C7H8N4OS
Molecular Weight:
196.2296
IUPAC Name:
4-oxido-1-phenyl-2,5-dihydrotetrazol-4-ium-5-thiol
InChI:
InChI=1S/C7H8N4OS/c12-11-7(13)10(8-9-11)6-4-2-1-3-5-6/h1-5,7-8,13H
InChI Key:
DPCGWSZXCOPYIV-UHFFFAOYSA-N
SMILES:
SC1N(O)N=NN1c1ccccc1
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.042g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.228g/mol
Monoisotopic Mass:
196.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.