tert-butyl N-(3,3,3-trifluoro-2-hydroxypropyl)carbamate

tert-butyl N-(3,3,3-trifluoro-2-hydroxypropyl)carbamate

CAS: 1219606-48-0

Formula: C8H14F3NO3

SMILES: CC(C)(C)OC(=O)NCC(O)C(F)(F)F

IUPAC: tert-butyl N-(3,3,3-trifluoro-2-hydroxypropyl)carbamate

InChI: InChI=1/C8H14F3NO3/c1-7(2,3)15-6(14)12-4-5(13)8(9,10)11/h5,13H,4H2,1-3H3,(H,12,14)

Composition: C (41.92%), H (6.16%), F (24.87%), N (6.11%), O (20.94%)

Molar Mass: 229.199

Atom Count: 29

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	229.092577804
Formal Charge	0
FSP3	0.87
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	NCSJLZBMIHPPLI-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.2
Topological Polar Surface Area	58.56
Polarizability	17.65
Ring Count	0
Rotatable Bond Count	5

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