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5-chloro-2H-indazole-6-carbonitrile

5-chloro-2H-indazole-6-carbonitrile

Formula: C8H4ClN3

SMILES: ClC1=CC2=CNN=C2C=C1C#N

IUPAC: 5-chloro-2H-indazole-6-carbonitrile

InChI: InChI=1S/C8H4ClN3/c9-7-1-6-4-11-12-8(6)2-5(7)3-10/h1-2,4H,(H,11,12)

Composition: C (54.11%), H (2.27%), Cl (19.96%), N (23.66%)

Molar Mass: 177.59

Atom Count: 16

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 177.0093748
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey SLHAQPTUSXWYSJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.35
Topological Polar Surface Area 52.47
Polarizability 18.36
Ring Count 2
Rotatable Bond Count 0

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Purity LeadTime Formula PacketSize UnitPrice
97% <7 Days C8H4ClN3 $280.50-$1,858.78$280.50$432.91$727.43$1,858.78
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98% <10 Days C8H4ClN3 Quote Only
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