200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 28751-69-1
28751-69-1 | 1H-Indazole-3-carbothioamide
CAS No: 28751-69-1 Catalog No: AG002WDI MDL No:MFCD09033800
Product Description
Catalog Number:
AG002WDI
Chemical Name:
1H-Indazole-3-carbothioamide
CAS Number:
28751-69-1
Molecular Formula:
C8H7N3S
Molecular Weight:
177.2263
MDL Number:
MFCD09033800
IUPAC Name:
1H-indazole-3-carbothioamide
InChI:
InChI=1S/C8H7N3S/c9-8(12)7-5-3-1-2-4-6(5)10-11-7/h1-4H,(H2,9,12)(H,10,11)
InChI Key:
YFXRXRMNOOOQSS-UHFFFAOYSA-N
SMILES:
NC(=S)c1n[nH]c2c1cccc2
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.036g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.225g/mol
Monoisotopic Mass:
177.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.