8-oxatricyclo[7.4.0.0²,?]trideca-1(9),2(7),3,5,10,12-hexaene-4-sulfonyl chloride

8-oxatricyclo[7.4.0.0²,?]trideca-1(9),2(7),3,5,10,12-hexaene-4-sulfonyl chloride

CAS: 23602-98-4

Formula: C12H7ClO3S

SMILES: ClS(=O)(=O)C1=CC2=C(OC3=C2C=CC=C3)C=C1

IUPAC: 8-oxatricyclo[7.4.0.0²,?]trideca-1(9),2(7),3,5,10,12-hexaene-4-sulfonyl chloride

InChI: InChI=1S/C12H7ClO3S/c13-17(14,15)8-5-6-12-10(7-8)9-3-1-2-4-11(9)16-12/h1-7H

Composition: C (54.04%), H (2.65%), Cl (13.29%), O (18.00%), S (12.02%)

Molar Mass: 266.7

Atom Count: 24

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	265.980443
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	ULCKEERECJMLHP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.42
Topological Polar Surface Area	47.28
Polarizability	28.23
Ring Count	3
Rotatable Bond Count	1

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