1-Butanol,2-[(phenylmethyl)amino]-, (2R)- supplier

Name
(R)(-)-2-BENZYLAMINO-1-BUTANOL
EINECS
CAS No. 6257-49-4
Article Data20
CAS DataBase
Density 1.004 g/cm³
Solubility
Melting Point 71-72 °C
Formula C₁₁H₁₇NO
Boiling Point 307.5 °C at 760 mmHg
Molecular Weight 179.262
Flash Point 114.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Butanol, 2-[(phenylmethyl)amino]-, (R)-;(R)-(-)-N-Benzyl-2-amino-1-butanol;(R)-2-Benzylamino-1-butanol;(R)-N-Benzyl-2-aminobutanol;
PSA 32.26000
LogP 1.93800

1-Butanol,2-[(phenylmethyl)amino]-, (2R)- Specification

The 1-Butanol,2-[(phenylmethyl)amino]-, (2R)-, with the CAS registry number 6257-49-4, is also known as (R)-(-)-2-Benzylamino-1-butanol. This chemical's molecular formula is C₁₁H₁₇NO and molecular weight is 179.26. What's more, its systematic name is called (2R)-2-(Benzylamino)butan-1-ol.

Physical properties about 1-Butanol,2-[(phenylmethyl)amino]-, (2R)- are: (1)ACD/LogP: 2.00; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 12.47 Å²; (7)Index of Refraction: 1.526; (8)Molar Refractivity: 54.78 cm³; (9)Molar Volume: 178.4 cm³; (10)Surface Tension: 38.7 dyne/cm; (11)Density: 1.004 g/cm³; (12)Flash Point: 114.8 °C; (13)Enthalpy of Vaporization: 57.87 kJ/mol; (14)Boiling Point: 307.5 °C at 760 mmHg; (15)Vapour Pressure: 0.000314 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OC[C@H](NCc1ccccc1)CC
(2) InChI: InChI=1/C11H17NO/c1-2-11(9-13)12-8-10-6-4-3-5-7-10/h3-7,11-13H,2,8-9H2,1H3/t11-/m1/s1
(3) InChIKey: PGFBTQBTIYCCFJ-LLVKDONJBQ

Product Name

(R)(-)-2-BENZYLAMINO-1-BUTANOL

1-Butanol,2-[(phenylmethyl)amino]-, (2R)- Specification

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