ChemSpider 2D Image | Benzyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucylisoleucyl-alpha-glutaminate | C29H46N4O7

Benzyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucylisoleucyl-α-glutaminate

  • Molecular FormulaC29H46N4O7
  • Average mass562.698 Da
  • Monoisotopic mass562.336670 Da
  • ChemSpider ID4402626

More details:

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

Benzyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucylisoleucyl-α-glutaminate [ACD/IUPAC Name]
Benzyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucylisoleucyl-α-glutaminat [German] [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}leucylisoleucyl-α-glutaminate de benzyle [French] [ACD/IUPAC Name]
α-Glutamine, N-[(1,1-dimethylethoxy)carbonyl]leucylisoleucyl-, phenylmethyl ester [ACD/Index Name]
5633-95-4 [RN]
BENZYL 4-(2-{2-[(TERT-BUTOXYCARBONYL)AMINO]-4-METHYLPENTANAMIDO}-3-METHYLPENTANAMIDO)-4-CARBAMOYLBUTANOATE
Benzyl N-(tert-butoxycarbonyl)leucylisoleucyl-α-glutaminate

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

UNM000000634401 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 798.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.1±3.0 kJ/mol
Flash Point: 436.5±32.9 °C
Index of Refraction: 1.516
Molar Refractivity: 150.8±0.3 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 227.76
ACD/KOC (pH 5.5): 1694.66
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 227.70
ACD/KOC (pH 7.4): 1694.26
Polar Surface Area: 166 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 499.3±3.0 cm3

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