ChemSpider 2D Image | Z-D-Chg-OH | C16H21NO4

Z-D-Chg-OH

  • Molecular FormulaC16H21NO4
  • Average mass291.342 Da
  • Monoisotopic mass291.147064 Da
  • ChemSpider ID18765784

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2R)-{[(Benzyloxy)carbonyl]amino}(cyclohexyl)acetic acid [ACD/IUPAC Name]
(2R)-{[(Benzyloxy)carbonyl]amino}(cyclohexyl)essigsäure [German] [ACD/IUPAC Name]
69901-85-5 [RN]
Acide (2R)-{[(benzyloxy)carbonyl]amino}(cyclohexyl)acétique [French] [ACD/IUPAC Name]
Cyclohexaneacetic acid, α-[[(phenylmethoxy)carbonyl]amino]-, (αR)- [ACD/Index Name]
MFCD00191082 [MDL number]
N-Z-D-α-Cyclohexylglycine
Z-D-Chg-OH
(2R)-2-{[(BENZYLOXY)CARBONYL]AMINO}-2-CYCLOHEXYLACETIC ACID
(R)-{[(BENZYLOXY)CARBONYL]AMINO}(CYCLOHEXYL)ACETIC ACID
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2222403 [DBID]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 492.1±38.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.9±3.0 kJ/mol
    Flash Point: 251.4±26.8 °C
    Index of Refraction: 1.552
    Molar Refractivity: 77.6±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.77
    ACD/LogD (pH 5.5): 1.49
    ACD/BCF (pH 5.5): 2.74
    ACD/KOC (pH 5.5): 20.12
    ACD/LogD (pH 7.4): -0.06
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 30.8±0.5 10-24cm3
    Surface Tension: 50.4±3.0 dyne/cm
    Molar Volume: 242.7±3.0 cm3

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