Found 2 results

Search term: MF = 'C_{24}H_{34}N_{2}O_{12}'
ChemSpider 2D Image | 3-{2-({N-[(Benzyloxy)carbonyl]-beta-alanyl}amino)-3-(2-carboxyethoxy)-2-[(2-carboxyethoxy)methyl]propoxy}propanoic acid | C24H34N2O12

3-{2-({N-[(Benzyloxy)carbonyl]-β-alanyl}amino)-3-(2-carboxyethoxy)-2-[(2-carboxyethoxy)methyl]propoxy}propanoic acid

  • Molecular FormulaC24H34N2O12
  • Average mass542.533 Da
  • Monoisotopic mass542.211182 Da
  • ChemSpider ID58814063

More details:

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

2,11-Dioxa-4,8-diazatetradecan-14-oic acid, 9,9-bis[(2-carboxyethoxy)methyl]-3,7-dioxo-1-phenyl- [ACD/Index Name]
3-{2-({N-[(Benzyloxy)carbonyl]-β-alanyl}amino)-3-(2-carboxyethoxy)-2-[(2-carboxyethoxy)methyl]propoxy}propanoic acid [ACD/IUPAC Name]
3-{2-({N-[(Benzyloxy)carbonyl]-β-alanyl}amino)-3-(2-carboxyethoxy)-2-[(2-carboxyethoxy)methyl]propoxy}propansäure [German] [ACD/IUPAC Name]
Acide 3-{2-({N-[(benzyloxy)carbonyl]-β-alanyl}amino)-3-(2-carboxyéthoxy)-2-[(2-carboxyéthoxy)méthyl]propoxy}propanoïque [French] [ACD/IUPAC Name]
3-[2-(3-{[(benzyloxy)carbonyl]amino}propanamido)-3-(2-carboxyethoxy)-2-[(2-carboxyethoxy)methyl]propoxy]propanoic acid
3-[2-(3-Benzyloxycarbonylamino-propionylamino)-3-(2-carboxy-ethoxy)-2-(2-carboxy-ethoxymethyl)-propoxy]-propionic acid
651354-82-4 [RN]
MFCD30187971

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

Density: 1.3±0.1 g/cm3
Boiling Point: 864.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.6±3.0 kJ/mol
Flash Point: 476.5±34.3 °C
Index of Refraction: 1.545
Molar Refractivity: 128.8±0.3 cm3
#H bond acceptors: 14
#H bond donors: 5
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 3
ACD/LogP: 1.88
ACD/LogD (pH 5.5): -2.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 207 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 58.2±3.0 dyne/cm
Molar Volume: 407.6±3.0 cm3

Click to predict properties on the Chemicalize site


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