ChemSpider 2D Image | 5-(Cyclopropylmethyl)-17,17,18,18-tetramethyl-13,16-dioxa-5-azaheptacyclo[13.5.2.1~2,8~.0~1,6~.0~2,14~.0~12,23~.0~15,19~]tricosa-8(23),9,11-trien-11-ol | C28H37NO3

5-(Cyclopropylmethyl)-17,17,18,18-tetramethyl-13,16-dioxa-5-azaheptacyclo[13.5.2.12,8.01,6.02,14.012,23.015,19]tricosa-8(23),9,11-trien-11-ol

  • Molecular FormulaC28H37NO3
  • Average mass435.598 Da
  • Monoisotopic mass435.277344 Da
  • ChemSpider ID23237688

More details:

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

5-(Cyclopropylmethyl)-17,17,18,18-tetramethyl-13,16-dioxa-5-azaheptacyclo[13.5.2.12,8.01,6.02,14.012,23.015,19]tricosa-8(23),9,11-trien-11-ol [German] [ACD/IUPAC Name]
5-(Cyclopropylmethyl)-17,17,18,18-tetramethyl-13,16-dioxa-5-azaheptacyclo[13.5.2.12,8.01,6.02,14.012,23.015,19]tricosa-8(23),9,11-trien-11-ol [ACD/IUPAC Name]
5-(Cyclopropylméthyl)-17,17,18,18-tétraméthyl-13,16-dioxa-5-azaheptacyclo[13.5.2.12,8.01,6.02,14.012,23.015,19]tricosa-8(23),9,11-trién-11-ol [French] [ACD/IUPAC Name]
7-(cyclopropylmethyl)-10,10,11,11-tetramethyl-5,6,7,8,9,9a,10,11-octahydro-8a,12a-ethano-4,8-methano[1]benzofuro[3,2-e]furo[2,3-g]isoquinolin-1(12bH)-ol
8a,12a-Ethano-4,8-methano-12bH-benzofuro[3,2-e]furo[2,3-g]isoquinolin-1-ol, 7-(cyclopropylmethyl)-5,6,7,8,9,9a,10,11-octahydro-10,10,11,11-tetramethyl- [ACD/Index Name]
(8R,9AR,12BR)-7-(CYCLOPROPYLMETHYL)-10,10,11,11-TETRAMETHYL-5,6,7,8,9,9A,10,11-OCTAHYDRO-8A,12A-ETHANO-4,8-METHANO[1]BENZOFURO[3,2-E]FURO[2,3-G]ISOQUINOLIN-1(12BH)-OL
3-cyclopropylmethyl-18,18-dimethyl-(15S)-13,16-dioxa-3-azaheptacyclo[13.5.2.12,8.01,6.06,14.07,12.015,19]tricosa-7,9,11-trien-11-ol
97393-31-2 [RN]
CHEMBL353876

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.654
Molar Refractivity: 123.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 2.19
ACD/KOC (pH 5.5): 9.53
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 75.63
ACD/KOC (pH 7.4): 329.21
Polar Surface Area: 42 Å2
Polarizability: 48.8±0.5 10-24cm3
Surface Tension: 58.8±5.0 dyne/cm
Molar Volume: 336.1±5.0 cm3

Click to predict properties on the Chemicalize site


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