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N-Boc-L-cyclohexylglycinol

  • Name N-Boc-L-cyclohexylglycinol
  • EINECSN/A
  • CAS No. 107202-39-1
  • Density1.037 g/cm3
  • PSA58.56000
  • LogP2.84320
  • Solubility66.35 mg/L in water at 25 ºC
  • Melting Point83-87 ºC
  • FormulaC13H25NO3
  • Boiling Point371.2 ºC at 760 mmHg
  • Molecular Weight243.346
  • Flash Point178.3 ºC
  • Transport InformationN/A
  • AppearanceN/A
  • Safety26
  • Risk Codes20/21/22-36/37/38
  • Molecular Structure
    Molecular Structure of 107202-39-1 (N-Boc-L-cyclohexylglycinol)
  • Hazard SymbolsHarmfulXn
  • SynonymsHarmfulXn
  • Article Data6

N-Boc-L-cyclohexylglycinol Specification

The N-Boc-L-cyclohexylglycinol, with the CAS registry number 107202-39-1, is also known as (S)-2-(tert-Butoxycarbonylamino)-2-cyclohexylethanol. It belongs to the product categories of Amino Acid Derivatives; Amino Alcohols; Peptide Synthesis. This chemical's molecular formula is C13H25NO3 and molecular weight is 243.34. What's more, its systematic name is tert-butyl [(1S)-1-cyclohexyl-2-hydroxyethyl]carbamate. It is stable at common pressure and temperature, and it should be sealed and stored in a cool and dry place. What's more, it should be protected from strong oxides.

Physical properties of N-Boc-L-cyclohexylglycinol are: (1)ACD/LogP: 2.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.9; (4)ACD/BCF (pH 5.5): 93.4; (5)ACD/KOC (pH 5.5): 895.36; (6)ACD/KOC (pH 7.4): 895.33; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 6; (10)Polar Surface Area: 38.77 Å2; (11)Index of Refraction: 1.482; (12)Molar Refractivity: 66.93 cm3; (13)Molar Volume: 234.4 cm3; (14)Surface Tension: 38.5 dyne/cm; (15)Density: 1.037 g/cm3; (16)Flash Point: 178.3 °C; (17)Enthalpy of Vaporization: 71.53 kJ/mol; (18)Boiling Point: 371.2 °C at 760 mmHg; (19)Vapour Pressure: 5.05E-07 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. 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)SMILES: O=C(OC(C)(C)C)N[C@H](CO)C1CCCCC1
(2)InChI: InChI=1S/C13H25NO3/c1-13(2,3)17-12(16)14-11(9-15)10-7-5-4-6-8-10/h10-11,15H,4-9H2,1-3H3,(H,14,16)/t11-/m1/s1
(3)InChIKey: YNBRORWNNGUYQA-LLVKDONJSA-N

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