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1H-imidazole-4-sulfonyl chloride hydrochloride

1H-imidazole-4-sulfonyl chloride hydrochloride

CAS: 1416352-08-3

Formula: C3H4Cl2N2O2S

SMILES: Cl.ClS(=O)(=O)C1=CNC=N1

IUPAC: 1H-imidazole-4-sulfonyl chloride hydrochloride

InChI: InChI=1S/C3H3ClN2O2S.ClH/c4-9(7,8)3-1-5-2-6-3;/h1-2H,(H,5,6);1H

Composition: C (17.75%), H (1.99%), Cl (34.92%), N (13.80%), O (15.76%), S (15.79%)

Molar Mass: 203.04

Atom Count: 14

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 201.937054
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey VCJZLWKWMAQMHG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 33.52
Topological Polar Surface Area 62.82
Polarizability 13.42
Ring Count 1
Rotatable Bond Count 1

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