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51096-49-2

51096-49-2 Structure

51096-49-2 Structure
IdentificationBack Directory
[Name]

(S)-(+)-2-BENZYLAMINO-1-PHENYLETHANOL
[CAS]

51096-49-2
[Synonyms]

amino-1-phenyL
(S)-(+)-2-BenzyL
(S)-(+)-2-Benzylamino-1-phenylethanol
(S)-2-Benzylamino-1-phenylethanol,99%e.e.
(1S)-1-phenyl-2-[(phenylmethyl)amino]ethanol
(S)-(+)-2-BENZYLAMINO-1-PHENYLETHANOL USP/EP/BP
Benzenemethanol, α-[[(phenylmethyl)amino]methyl]-, (αS)-
[Molecular Formula]

C15H17NO
[MDL Number]

MFCD03427123
[MOL File]

51096-49-2.mol
[Molecular Weight]

227.3
Chemical PropertiesBack Directory
[Melting point ]

115-118 °C(lit.)
[alpha ]

57 º (C=1 IN CHLOROFORM)
[Boiling point ]

375.2±12.0 °C(Predicted)
[density ]

1.100±0.06 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[pka]

13.78±0.20(Predicted)
[Optical Rotation]

[α]20/D +57°, c = 1 in chloroform
[InChI]

1S/C15H17NO/c17-15(14-9-5-2-6-10-14)12-16-11-13-7-3-1-4-8-13/h1-10,15-17H,11-12H2/t15-/m1/s1
[InChIKey]

XAOCLQUZOIZSHV-OAHLLOKOSA-N
[SMILES]

O[C@H](CNCc1ccccc1)c2ccccc2
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[HS Code ]

29062990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

White powder
[Uses]

(S)-(+)-2-Benzylamino-1-phenylethanol can be used as an intermediate in the synthesis of aziridines using α-amino and α-amido ketones via asymmetric transfer?hydrogenation?reaction.
[General Description]

(S)-2-Benzylamino-1-phenylethanol can be used as a starting material in the preparation of iron catalysts applicable in the oxidation of secondary alcohols and benzylic methylene groups.
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