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2H-indazole-7-carbothioamide

2H-indazole-7-carbothioamide

CAS: 1186195-19-6

Formula: C8H7N3S

SMILES: NC(=S)C1=CC=CC2=CNN=C12

IUPAC: 2H-indazole-7-carbothioamide

InChI: InChI=1S/C8H7N3S/c9-8(12)6-3-1-2-5-4-10-11-7(5)6/h1-4H,(H2,9,12)(H,10,11)

Composition: C (54.22%), H (3.98%), N (23.71%), S (18.09%)

Molar Mass: 177.23

Atom Count: 19

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 177.036068411
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey HHWHQKFVHBJFPG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.89
Topological Polar Surface Area 54.7
Polarizability 20.9
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <14 Days 1186195-19-6 $623.70$623.70
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