2-(benzenesulfonyl)-2-azaspiro[3.3]heptan-6-one

2-(benzenesulfonyl)-2-azaspiro[3.3]heptan-6-one

CAS: 1363381-24-1

Formula: C12H13NO3S

SMILES: O=C1CC2(CN(C2)S(=O)(=O)C2=CC=CC=C2)C1

IUPAC: 2-(benzenesulfonyl)-2-azaspiro[3.3]heptan-6-one

InChI: InChI=1S/C12H13NO3S/c14-10-6-12(7-10)8-13(9-12)17(15,16)11-4-2-1-3-5-11/h1-5H,6-9H2

Composition: C (57.35%), H (5.21%), N (5.57%), O (19.10%), S (12.76%)

Molar Mass: 251.3

Atom Count: 30

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	251.061614457
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	XIJPPBUHBDRFTN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.11
Topological Polar Surface Area	54.45
Polarizability	25.3
Ring Count	3
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1363381-24-1		$74.40-$305.16$74.40$124.84$305.16