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trans-4-Aminocyclohexanecarboxylic acid hydrochloride

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  • Name trans-4-Aminocyclohexanecarboxylic acid hydrochloride
  • EINECSN/A
  • CAS No. 27960-59-4
  • DensityN/A
  • PSA63.32000
  • LogP2.09080
  • SolubilitySoluble in water.
  • Melting Point>300℃
  • FormulaC7H13NO2·ClH
  • Boiling Point312.2 °C at 760 mmHg
  • Molecular Weight179.647
  • Flash Point142.6 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 27960-59-4 (TRANS-4-AMINO-CYCLOHEXANE CARBOXYLIC ACID HYDROCHLORIDE)
  • Hazard SymbolsIrritantXi
  • SynonymsIrritantXi

trans-4-Aminocyclohexanecarboxylic acid hydrochloride Specification

The Cyclohexanecarboxylicacid, 4-amino-, hydrochloride (1:1), trans-, with the CAS registry number 27960-59-4, is also known as trans-4-Aminocyclohexanecarboxylicacid hydrochloride. This chemical's molecular formula is C7H13NO2·ClH and formula weight is 179.64. What's more, its systematic name is 4-aminocyclohexane-1-carboxylic acid hydrochloride.

Physical properties of Cyclohexanecarboxylicacid, 4-amino-, hydrochloride (1:1), trans- are: (1)ACD/LogP: 0.12; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 63.32 Å2; (7)Flash Point: 142.6 °C; (8)Enthalpy of Vaporization: 60.83 kJ/mol; (9)Boiling Point: 312.2 °C at 760 mmHg; (10)Vapour Pressure: 0.000118 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H]1CC[C@@H](N)CC1.Cl
(2)InChI: InChI=1S/C7H13NO2.ClH/c8-6-3-1-5(2-4-6)7(9)10;/h5-6H,1-4,8H2,(H,9,10);1H/t5-,6-;
(3)InChIKey: HXZSYUOXTKQNNY-KYOXOEKESA-N

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