ChemSpider 2D Image | N-Acetyl-3-(2-naphthyl)alanyl-4-chlorophenylalanyl-3-(3-pyridinyl)alanylseryltyrosyl-N~5~-carbamoylornithylleucylarginylprolylalaninamide | C70H92ClN17O14

N-Acetyl-3-(2-naphthyl)alanyl-4-chlorophenylalanyl-3-(3-pyridinyl)alanylseryltyrosyl-N5-carbamoylornithylleucylarginylprolylalaninamide

  • Molecular FormulaC70H92ClN17O14
  • Average mass1431.038 Da
  • Monoisotopic mass1429.669800 Da
  • ChemSpider ID10625810

More details:






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

Alaninamide, N-acetyl-3-(2-naphthalenyl)alanyl-4-chlorophenylalanyl-3-(3-pyridinyl)alanylseryltyrosyl-N5-(aminocarbonyl)ornithylleucylarginylprolyl- [ACD/Index Name]
N-Acetyl-3-(2-naphthyl)alanyl-4-chlorophenylalanyl-3-(3-pyridinyl)alanylseryltyrosyl-N5-carbamoylornithylleucylarginylprolylalaninamide [ACD/IUPAC Name]
N-Acetyl-3-(2-naphthyl)alanyl-4-chlorphenylalanyl-3-(3-pyridinyl)alanylseryltyrosyl-N5-carbamoylornithylleucylarginylprolylalaninamid [German] [ACD/IUPAC Name]
N-Acétyl-3-(2-naphtyl)alanyl-4-chlorophénylalanyl-3-(3-pyridinyl)alanylséryltyrosyl-N5-carbamoylornithylleucylarginylprolylalaninamide [French] [ACD/IUPAC Name]
120287-85-6 [RN]
130143-01-0 [RN]
Cetrorelix(Cetrorelix acetate)
MFCD00884467 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.668
Molar Refractivity: 373.9±0.5 cm3
#H bond acceptors: 31
#H bond donors: 20
#Freely Rotating Bonds: 39
#Rule of 5 Violations: 3
ACD/LogP: 2.69
ACD/LogD (pH 5.5): -1.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 496 Å2
Polarizability: 148.2±0.5 10-24cm3
Surface Tension: 61.2±7.0 dyne/cm
Molar Volume: 1003.4±7.0 cm3

Click to predict properties on the Chemicalize site






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