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Basic information

  • Name:
  • 1-Piperidinecarboxylicacid, 3-amino-, 1,1-dimethylethyl ester, (3R)-

  • Superlist Name:
  • (R)-1-Boc-3-Aminopiperidine
  • CAS No.:
  • 188111-79-7

  • Molecular Structure:
  • Formula:
  • C10H20N2O2
  • Molecular Weight:
  • 200.28
  • Boiling Point:
  • 277.3 °C at 760 mmHg
  • Flash Point:
  • 121.5 °C
  • Hazard Symbols:
  • HarmfulXn
  • Risk Codes:
  • 22-36/37/38
  • Safety Description:
  • 26 Details
  • Transport Information:
  • UN 2735

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Specification

The (R)-1-Boc-3-aminopiperidine, with the CAS registry number 188111-79-7, is also known as (R)-3-Amino-1-N-Boc-piperidine. It belongs to the product categories of Aminoacid; Pharmacetical; Piperidine; Piperidine Series; Piperidines; Chiral Chemicals. This chemical's molecular formula is C10H20N2O2 and molecular weight is 200.278. Its IUPAC name is called tert-butyl (3R)-3-aminopiperidine-1-carboxylate.

Physical properties of (R)-1-Boc-3-aminopiperidine: (1)ACD/LogP: 0.71; (2)ACD/LogD (pH 5.5): -2.35; (3)ACD/LogD (pH 7.4): -1.53; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.483; (12)Molar Refractivity: 54.99 cm3; (13)Molar Volume: 192.2 cm3; (14)Surface Tension: 37.8 dyne/cm; (15)Density: 1.041 g/cm3; (16)Flash Point: 121.5 °C; (17)Enthalpy of Vaporization: 51.59 kJ/mol; (18)Boiling Point: 277.3 °C at 760 mmHg; (19)Vapour Pressure: 0.00456 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful if swallowed. In addition, 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.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)(C)OC(=O)N1CCCC(C1)N
(2)Isomeric SMILES: CC(C)(C)OC(=O)N1CCC[C@H](C1)N
(3)InChI: InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-6-4-5-8(11)7-12/h8H,4-7,11H2,1-3H3/t8-/m1/s1
(4)InChIKey: AKQXKEBCONUWCL-MRVPVSSYSA-N

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