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Cyclohexanecarboxylicacid, 2-amino-, (1R,2R)-

  • Name Cyclohexanecarboxylicacid, 2-amino-, (1R,2R)-
  • EINECSN/A
  • CAS No. 26685-83-6
  • Density1.133 g/cm3
  • PSA63.32000
  • LogP1.28880
  • SolubilitySoluble in water.
  • Melting Point0 °C
  • FormulaC7H13NO2
  • Boiling Point280 °C at 760 mmHg
  • Molecular Weight143.186
  • Flash Point123.1 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety26-36/37/39
  • Risk Codes36/37/38
  • Molecular Structure
    Molecular Structure of 26685-83-6 ((1R,2R)-2-AMINOCYCLOHEXANECARBOXYLIC ACID)
  • Hazard SymbolsXi
  • SynonymsXi
  • Article Data13

Cyclohexanecarboxylicacid, 2-amino-, (1R,2R)- Specification

The Cyclohexanecarboxylicacid, 2-amino-, (1R,2R)-, with the CAS registry number 26685-83-6, is also known as trans-(1R,2R)-2-Aminocyclohexanecarboxylic acid and Cyclohexanecarboxylicacid, 2-amino-, (1R,2R)-(-)- (8CI). It belongs to the product categories of Carboxylic Acids (Chiral); Chiral Building Blocks; Synthetic Organic Chemistry. This chemical's molecular formula is C7H13NO2 and molecular weight is 143.18. What's more, its IUPAC name is (1R,2R)-2-Aminocyclohexane-1-carboxylic acid.

Physical properties about Cyclohexanecarboxylicacid, 2-amino-, (1R,2R)- are: (1) ACD/LogP: 0.26; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): -2.25; (4) ACD/LogD (pH 7.4): -2.24; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1; (7) ACD/KOC (pH 5.5): 1; (8) ACD/KOC (pH 7.4): 1; (9) #H bond acceptors: 3; (10) #H bond donors: 3; (11) #Freely Rotating Bonds: 2; (12) Polar Surface Area: 29.54 Å2; (13) Index of Refraction: 1.503; (14) Molar Refractivity: 37.33 cm3; (15) Molar Volume: 126.2 cm3; (16) Polarizability: 14.79×10-24 cm3; (17) Surface Tension: 45.8 dyne/cm; (18) Density: 1.133 g/cm3; (19) Flash Point: 123.1 °C; (20) Enthalpy of Vaporization: 57.08 kJ/mol; (21) Boiling Point: 280 °C at 760 mmHg; (22) Vapour Pressure: 0.00103 mmHg at 25 °C.

When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes, respiratory system and skin. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. 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(O)[C@@H]1CCCC[C@H]1N
(2) InChI: InChI=1/C7H13NO2/c8-6-4-2-1-3-5(6)7(9)10/h5-6H,1-4,8H2,(H,9,10)/t5-,6-/m1/s1
(3) InChIKey: USQHEVWOPJDAAX-PHDIDXHHBP

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