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1H-indazol-4-ylboronic acid hydrochloride

1H-indazol-4-ylboronic acid hydrochloride

CAS: 1252598-02-9

Formula: C7H8BClN2O2

SMILES: Cl.OB(O)C1=C2C=NNC2=CC=C1

IUPAC: (1H-indazol-4-yl)boronic acid hydrochloride

InChI: InChI=1S/C7H7BN2O2.ClH/c11-8(12)6-2-1-3-7-5(6)4-9-10-7;/h1-4,11-12H,(H,9,10);1H

Composition: C (42.37%), H (4.06%), B (5.45%), Cl (17.87%), N (14.12%), O (16.13%)

Molar Mass: 198.41

Atom Count: 21

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 198.036735
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey PAILGUQNESDYLX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.62
Topological Polar Surface Area 69.14
Polarizability 17.85
Ring Count 2
Rotatable Bond Count 1

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 1252598-02-9 $381.80-$1,699.70$381.80$1,061.45$1,699.70
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