1-(benzylamino)-4,4,4-trifluorobutan-2-ol

1-(benzylamino)-4,4,4-trifluorobutan-2-ol

CAS: 939793-42-7

Formula: C11H14F3NO

SMILES: OC(CNCC1=CC=CC=C1)CC(F)(F)F

IUPAC: 1-(benzylamino)-4,4,4-trifluorobutan-2-ol

InChI: InChI=1/C11H14F3NO/c12-11(13,14)6-10(16)8-15-7-9-4-2-1-3-5-9/h1-5,10,15-16H,6-8H2

Composition: C (56.65%), H (6.05%), F (24.44%), N (6.01%), O (6.86%)

Molar Mass: 233.234

Atom Count: 30

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	233.102748564
Formal Charge	0
FSP3	0.45
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	FIPYXVWKZLCGAE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.17
Topological Polar Surface Area	32.26
Polarizability	20.93
Ring Count	1
Rotatable Bond Count	6

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