1,1,1-trifluoro-3-(thiomorpholin-4-yl)propan-2-ol

1,1,1-trifluoro-3-(thiomorpholin-4-yl)propan-2-ol

CAS: 478068-13-2

Formula: C7H12F3NOS

SMILES: OC(CN1CCSCC1)C(F)(F)F

IUPAC: 1,1,1-trifluoro-3-(thiomorpholin-4-yl)propan-2-ol

InChI: InChI=1/C7H12F3NOS/c8-7(9,10)6(12)5-11-1-3-13-4-2-11/h6,12H,1-5H2

Composition: C (39.06%), H (5.62%), F (26.48%), N (6.51%), O (7.43%), S (14.90%)

Molar Mass: 215.23

Atom Count: 25

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	215.059169673
Formal Charge	0
FSP3	1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	VULXDDBOUZXLRM-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.76
Topological Polar Surface Area	23.47
Polarizability	17.55
Ring Count	1
Rotatable Bond Count	3

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	478068-13-2		$51.35-$524.40$51.35$63.37$86.31$524.40