2,3-dihydro-1,4-benzodioxine-6-sulfonyl chloride

2,3-dihydro-1,4-benzodioxine-6-sulfonyl chloride

CAS: 63758-12-3

Formula: C8H7ClO4S

SMILES: ClS(=O)(=O)C1=CC2=C(OCCO2)C=C1

IUPAC: 2,3-dihydro-1,4-benzodioxine-6-sulfonyl chloride

InChI: InChI=1S/C8H7ClO4S/c9-14(10,11)6-1-2-7-8(5-6)13-4-3-12-7/h1-2,5H,3-4H2

Composition: C (40.95%), H (3.01%), Cl (15.11%), O (27.27%), S (13.66%)

Molar Mass: 234.65

Atom Count: 21

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	233.9753576
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	JWHSRWUHRLYAPM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.21
Topological Polar Surface Area	52.6
Polarizability	20.82
Ring Count	2
Rotatable Bond Count	1

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