Found 67 results

Search term: MF = 'C_{34}H_{38}N_{4}O_{8}'
ChemSpider 2D Image | (7R,12S)-7-Benzyl-26-methyl-9,14,24,27-tetraoxo-7,8,9,10,11,12,13,14,20,21,22,23,24,25,26,27-hexadecahydro-6H-dibenzo[k,v][1,13,4,9,17,20]dioxatetraazacyclotricosine-12-carboxylic acid | C34H38N4O8

(7R,12S)-7-Benzyl-26-methyl-9,14,24,27-tetraoxo-7,8,9,10,11,12,13,14,20,21,22,23,24,25,26,27-hexadecahydro-6H-dibenzo[k,v][1,13,4,9,17,20]dioxatetraazacyclotricosine-12-carboxylic acid

  • Molecular FormulaC34H38N4O8
  • Average mass630.688 Da
  • Monoisotopic mass630.268982 Da
  • ChemSpider ID80822417

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(7R,12S)-7-Benzyl-26-methyl-9,14,24,27-tetraoxo-7,8,9,10,11,12,13,14,20,21,22,23,24,25,26,27-hexadecahydro-6H-dibenzo[k,v][1,13,4,9,17,20]dioxatetraazacyclotricosin-12-carbonsäure [German] [ACD/IUPAC Name]
(7R,12S)-7-Benzyl-26-methyl-9,14,24,27-tetraoxo-7,8,9,10,11,12,13,14,20,21,22,23,24,25,26,27-hexadecahydro-6H-dibenzo[k,v][1,13,4,9,17,20]dioxatetraazacyclotricosine-12-carboxylic acid [ACD/IUPAC Name]
6H-Dibenzo[k,v][1,13,4,9,17,20]dioxatetraazacyclotricosine-12-carboxylic acid, 7,8,9,10,11,12,13,14,20,21,22,23,24,25,26,27-hexadecahydro-26-methyl-9,14,24,27-tetraoxo-7-(phenylmethyl)-, (7R,12S)- [ACD/Index Name]
Acide (7R,12S)-7-benzyl-26-méthyl-9,14,24,27-tétraoxo-7,8,9,10,11,12,13,14,20,21,22,23,24,25,26,27-hexadécahydro-6H-dibenzo[k,v][1,13,4,9,17,20]dioxatétraazacyclotricosine-12-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 1001.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 153.1±3.0 kJ/mol
Flash Point: 559.7±34.3 °C
Index of Refraction: 1.546
Molar Refractivity: 166.5±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -0.20
ACD/LogD (pH 5.5): -0.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.19
ACD/LogD (pH 7.4): -2.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 163 Å2
Polarizability: 66.0±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 525.4±3.0 cm3

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