3-iodo-1??-thiolane-1,1-dione

3-iodo-1??-thiolane-1,1-dione

CAS: 17236-22-5

Formula: C4H7IO2S

SMILES: IC1CCS(=O)(=O)C1

IUPAC: 3-iodo-1??-thiolane-1,1-dione

InChI: InChI=1/C4H7IO2S/c5-4-1-2-8(6,7)3-4/h4H,1-3H2

Composition: C (19.53%), H (2.87%), I (51.57%), O (13.00%), S (13.03%)

Molar Mass: 246.06

Atom Count: 15

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	245.92115
Formal Charge	0
FSP3	1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CGOFTYIAIKDBLL-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.22
Topological Polar Surface Area	34.14
Polarizability	16.89
Ring Count	1
Rotatable Bond Count	0

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