ChemSpider 2D Image | ?-valerobetaine | C8H17NO2

?-valerobetaine

  • Molecular FormulaC8H17NO2
  • Average mass159.226 Da
  • Monoisotopic mass159.125931 Da
  • ChemSpider ID34236878

More details:

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

?-valerobetaine
1-Butanaminium, 4-carboxy-N,N,N-trimethyl-, inner salt [ACD/Index Name]
5-(Trimethylammonio)pentanoat [German] [ACD/IUPAC Name]
5-(Trimethylammonio)pentanoate [ACD/IUPAC Name]
5-(Triméthylammonio)pentanoate [French] [ACD/IUPAC Name]
6778-33-2 [RN]
δ-VALEROBETAINE
(4-carboxy-butyl)-trimethyl-ammonium βine
5-(trimethylazaniumyl)pentanoate
δ-Valerobetaine

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

725A8L267W [DBID]
UNII:725A8L267W [DBID]

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

    Density:
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction:
    Molar Refractivity:
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: -3.87
    ACD/LogD (pH 5.5): -2.90
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.14
    ACD/LogD (pH 7.4): -2.87
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.22
    Polar Surface Area: 40 Å2
    Polarizability:
    Surface Tension:
    Molar Volume:

    Click to predict properties on the Chemicalize site


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