4-(pentan-3-yl)-1??-thiomorpholine-1,1-dione

4-(pentan-3-yl)-1??-thiomorpholine-1,1-dione

CAS: 866041-16-9

Formula: C9H19NO2S

SMILES: CCC(CC)N1CCS(=O)(=O)CC1

IUPAC: 4-(pentan-3-yl)-1??-thiomorpholine-1,1-dione

InChI: InChI=1S/C9H19NO2S/c1-3-9(4-2)10-5-7-13(11,12)8-6-10/h9H,3-8H2,1-2H3

Composition: C (52.65%), H (9.33%), N (6.82%), O (15.58%), S (15.61%)

Molar Mass: 205.32

Atom Count: 32

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	205.11365003
Formal Charge	0
FSP3	1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	DNZICLJLTDSWGE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.81
Topological Polar Surface Area	37.38
Polarizability	22.28
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	866041-16-9		$51.35-$86.31$51.35$63.37$86.31