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chloramine B

chloramine B

CAS: 127-52-6

Formula: C6H5ClNNaO2S

SMILES: [Na+].[O-]S(=O)(=NCl)C1=CC=CC=C1

IUPAC: sodium (chloroimino)(phenyl)-λ⁶-sulfanoylolate

InChI: InChI=1S/C6H6ClNO2S.Na/c7-8-11(9,10)6-4-2-1-3-5-6;/h1-5H,(H,8,9,10);/q;+1/p-1

Composition: C (33.74%), H (2.36%), Cl (16.60%), N (6.56%), Na (10.76%), O (14.98%), S (15.01%)

Molar Mass: 213.61

Atom Count: 17

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 212.9627216
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey FTDKYSGFGRDGGE-UHFFFAOYSA-M
Lipinski's Rule of Five 1
Molar Refractivity 44.97
Topological Polar Surface Area 52.49
Polarizability 17.42
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS UnitPrice
99% <10 Days 127-52-6 Quote Only