tert-butyl 3-(hydroxymethyl)-3-(trifluoromethyl)pyrrolidine-1-carboxylate

tert-butyl 3-(hydroxymethyl)-3-(trifluoromethyl)pyrrolidine-1-carboxylate

CAS: 1283720-61-5

Formula: C11H18F3NO3

SMILES: CC(C)(C)OC(=O)N1CCC(CO)(C1)C(F)(F)F

IUPAC: tert-butyl 3-(hydroxymethyl)-3-(trifluoromethyl)pyrrolidine-1-carboxylate

InChI: InChI=1/C11H18F3NO3/c1-9(2,3)18-8(17)15-5-4-10(6-15,7-16)11(12,13)14/h16H,4-7H2,1-3H3

Composition: C (49.07%), H (6.74%), F (21.17%), N (5.20%), O (17.83%)

Molar Mass: 269.264

Atom Count: 36

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	269.123877933
Formal Charge	0
FSP3	0.91
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	SDHBRGFJKCOGRS-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.81
Topological Polar Surface Area	49.77
Polarizability	22.32
Ring Count	1
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	1283720-61-5		$255.65-$438.84$255.65$438.84

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<6 Days	1283720-61-5		$346.15-$1,131.60$346.15$479.55$1,131.60

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1283720-61-5		$2,200.00-$5,040.00$2,200.00$3,300.00$5,040.00