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80696-28-2

Basic Information
CAS No.: 80696-28-2
Name: D-NORLEUCINOL
Article Data: 6
Molecular Structure:
Molecular Structure of 80696-28-2 (D-NORLEUCINOL)
Formula: C6H15NO
Molecular Weight: 117.191
Synonyms: 1-Hexanol,2-amino-, (R)-;(R)-2-Amino-1-hexanol;D-Norleucinol;
Density: 0.907 g/cm3
Melting Point: 40-44 °C
Boiling Point: 191.9 °C at 760 mmHg
Flash Point: 100 °C
Appearance: Colorless liquid or low melting solid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 46.25000
LogP: 1.19650
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Specification

The 1-Hexanol, 2-amino-,(2R)-, with the CAS registry number 80696-28-2, is also known as D-Norleucinol. This chemical's molecular formula is C6H15NO and molecular weight is 117.19. What's more, its systematic name is (2R)-2-aminohexan-1-ol.

Physical properties of 1-Hexanol, 2-amino-,(2R)- are: (1)ACD/LogP: 0.63; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 12.47 Å2; (7)Index of Refraction: 1.452; (8)Molar Refractivity: 34.87 cm3; (9)Molar Volume: 129.1 cm3; (10)Polarizability: 13.82×10-24cm3; (11)Surface Tension: 34.9 dyne/cm; (12)Density: 0.907 g/cm3; (13)Flash Point: 100 °C; (14)Enthalpy of Vaporization: 49.82 kJ/mol; (15)Boiling Point: 191.9 °C at 760 mmHg; (16)Vapour Pressure: 0.135 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: OC[C@H](N)CCCC
(2)InChI: InChI=1S/C6H15NO/c1-2-3-4-6(7)5-8/h6,8H,2-5,7H2,1H3/t6-/m1/s1
(3)InChIKey: DPEOTCPCYHSVTC-ZCFIWIBFSA-N