ChemSpider 2D Image | Hematoporphyrin | C34H38N4O6


  • Molecular FormulaC34H38N4O6
  • Average mass598.689 Da
  • Monoisotopic mass598.279114 Da
  • ChemSpider ID10632
  • Double-bond stereo - Double-bond stereo

More details:

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

3,3'-[(2Z,7Z,11Z,17Z)-9,14-Bis(1-hydroxyethyl)-5,10,15,19-tetramethyl-21,22,23,24-tetraazapentacyclo[,6.18,11.113,16]tetracosa-1(21),2,4,6(24),7,9,11,13,15,17,19-undecaen-4,20-diyl]dipropansäure [German]
3,3'-[7,12-Bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-2,18-porphyrindiyl]dipropansäure [German] [ACD/IUPAC Name]
Acide 3,3'-[(2Z,7Z,11Z,17Z)-9,14-bis(1-hydroxyéthyl)-5,10,15,19-tétraméthyl-21,22,23,24-tétraazapentacyclo[,6.18,11.113,16]tétracosa-1(21),2,4,6(24),7,9,11,13,15,17,19-undécaène-4,20-diyl]dipropanoïque [French]
Acide 3,3'-[7,12-bis(1-hydroxyéthyl)-3,8,13,17-tétraméthyl-2,18-porphyrinediyl]dipropanoïque [French] [ACD/IUPAC Name]
Hematoporphyrin [Wiki]
136752-88-0 [RN]
553-11-7 [RN]
670-69-9 [RN]
885267-28-7 [RN]

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

AIDS012104 [DBID]
AIDS-012104 [DBID]
BRN 0078957 [DBID]
KBio2_001684 [DBID]
KBio2_004252 [DBID]
KBio2_006820 [DBID]
KBio3_002040 [DBID]
KBioGR_002346 [DBID]
KBioSS_001684 [DBID]
NSC 267084 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1192.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 185.2±3.0 kJ/mol
Flash Point: 675.1±34.3 °C
Index of Refraction: 1.638
Molar Refractivity: 162.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 4.84
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: 172 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 64.6±3.0 dyne/cm
Molar Volume: 453.3±3.0 cm3

Click to predict properties on the Chemicalize site