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28751-70-4 | 1H-Indazole-3-carboxamide, 5-chloro-
CAS No: 28751-70-4 Catalog No: AG002WDH MDL No:MFCD20706734
Product Description
Catalog Number:
AG002WDH
Chemical Name:
1H-Indazole-3-carboxamide, 5-chloro-
CAS Number:
28751-70-4
Molecular Formula:
C8H6ClN3O
Molecular Weight:
195.6057
MDL Number:
MFCD20706734
IUPAC Name:
5-chloro-1H-indazole-3-carboxamide
InChI:
InChI=1S/C8H6ClN3O/c9-4-1-2-6-5(3-4)7(8(10)13)12-11-6/h1-3H,(H2,10,13)(H,11,12)
InChI Key:
LDYDVRNVSHVIBN-UHFFFAOYSA-N
SMILES:
NC(=O)c1n[nH]c2c1cc(Cl)cc2
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.02g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.606g/mol
Monoisotopic Mass:
195.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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