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sodium chloro(2-methylbenzenesulfonyl)azanide

sodium chloro(2-methylbenzenesulfonyl)azanide

CAS: 110076-44-3

Formula: C7H7ClNNaO2S

SMILES: [Na+].CC1=CC=CC=C1S(=O)(=O)[N-]Cl

IUPAC: sodium chloro(2-methylbenzenesulfonyl)azanide

InChI: InChI=1S/C7H7ClNO2S.Na/c1-6-4-2-3-5-7(6)12(10,11)9-8;/h2-5H,1H3;/q-1;+1

Composition: C (36.93%), H (3.10%), Cl (15.57%), N (6.15%), Na (10.10%), O (14.06%), S (14.08%)

Molar Mass: 227.64

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 226.9783716
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey BMVGZYMMLBPFDA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.79
Topological Polar Surface Area 43.37
Polarizability 19.02
Ring Count 1
Rotatable Bond Count 1

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98% <14 Days 110076-44-3 Quote Only