ChemSpider 2D Image | Naphthalocyanine | C48H26N8

Naphthalocyanine

  • Molecular FormulaC48H26N8
  • Average mass714.774 Da
  • Monoisotopic mass714.228027 Da
  • ChemSpider ID4677874

More details:

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

(2Z,14Z,15Z,27Z,41Z)-2,15,28,41,53,54,55,56-Octaazatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4(13),5,7 ,9,11,14(56),16(55),17(26),18,20,22,24,27,29,31,33,35,37,39,41,43(52),44,46,48,50-heptacosaen [German] [ACD/IUPAC Name]
(2Z,14Z,15Z,27Z,41Z)-2,15,28,41,53,54,55,56-Octaazatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4(13),5,7 ,9,11,14(56),16(55),17(26),18,20,22,24,27,29,31,33,35,37,39,41,43(52),44,46,48,50-heptacosaene [ACD/IUPAC Name]
(2Z,14Z,15Z,27Z,41Z)-2,15,28,41,53,54,55,56-Octaazatridécacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4(13),5,7 ,9,11,14(56),16(55),17(26),18,20,22,24,27,29,31,33,35,37,39,41,43(52),44,46,48,50-heptacosaène [French] [ACD/IUPAC Name]
2,3-Naphthalocyanine
23627-89-6 [RN]
MFCD00134560
Naphthalocyanine [Wiki]

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

4345876 [DBID]
381896_SIAL [DBID]

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

Density: 1.5±0.0 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.970
Molar Refractivity: 232.4±0.0 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 13.04
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 109 Å2
Polarizability: 92.1±0.0 10-24cm3
Surface Tension: 93.6±0.0 dyne/cm
Molar Volume: 474.4±0.0 cm3

Click to predict properties on the Chemicalize site


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