Cas no 14643-66-4 (21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetramethyl-)

21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetramethyl- structure
14643-66-4 structure
Product Name:21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetramethyl-
CAS No:14643-66-4
MF:C36H38N4O8
MW:654.708929538727
MDL:MFCD06804602
CID:176497
PubChem ID:114935
Update Time:2025-04-19

21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetramethyl- Chemical and Physical Properties

Names and Identifiers

    • 21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetramethyl-
    • COPROPORPHYRIN III DIHYDROCHLORIDE
    • Coproporphyrin III dihydrochloride,3,8,13,17-Tetramethyl-21H,23H-porphine-2,7,12,18-tetrapropionic acid dihydrochloride
    • 2,7,12,18-Tetramethyl-21H,23H-porphyrin-3,8,13,17-tetrapropionic acid
    • 3,3',3'',3'''-(3,8,13,17-tetramethyl-21H,23H-porphine-2,7,12,18-tetrayl)-tetrakis-propionic acid
    • 3,3',3'',3'''-(3,8,13,17-tetramethyl-porphyrin-2,7,12,18-tetrayl)-tetra-propionic acid
    • 3,3',3'',3'''-(3,8,13,17-Tetramethyl-porphyrin-2,7,12,18-tetrayl)-tetra-propionsaeure
    • coproporphyrin
    • Coproporphyrin II
    • CoproporphyrinIII Dihyrochloride
    • coproporphyriniii2HCl
    • Coproporphyrin dihydrochloride
    • Coproporphyrin Ⅲ dihydrochloride
    • 3,8,13,17-tetramethylporphyrin-2,7,12,18-tetrapropanoic acid
    • 3,8,13,17-TETRAMETHYL-21H,23H-PORPHINE-2,7,12, 18-TETRAPROPIONIC ACID DIHYDROCHLORIDE
    • CoproporphyrinIII Dihyrochloride
    • Coproporphyrin III
    • Koproporphyrin
    • 3-[8,13,18-tris(2-carboxyethyl)-3,7,12,17-tetramethyl-21,24-dihydroporphyrin-2-yl]propanoic acid
    • Koproporphyrin III
    • Zinc coproporphyrin III
    • AS-72746
    • ETX4TFE9GJ
    • 14643-66-4
    • 3-[(5Z,10Z,14Z,19Z)-8,12,17-tris(2-carboxyethyl)-3,7,13,18-tetramethyl-21,23-dihydroporphyrin-2-yl]propanoic acid
    • 21H,23H-Porphine-2,7,12,18-tetrapropanoic acid, 3,8,13,17-tetramethyl-
    • CHEBI:27609
    • 3,8,13,17-Tetramethyl-21H,23H-porphine-2,7,12,18-tetrapropanoic acid
    • 3,3',3'',3'''-(3,8,13,17-Tetramethylporphyrin-2,7,12,18-tetrayl)tetrapropanoic acid
    • SCHEMBL3765609
    • Zincphyrin
    • JWFCYWSMNRLXLX-UJJXFSCMSA-N
    • DTXSID50904307
    • C05770
    • Coproporphyrin III tetrasodium
    • AKOS037647184
    • DTXSID20864520
    • COPROPORPHYRINIIIDIHYDROCHLORIDE
    • SCHEMBL498526
    • XNBNKCLBGTWWSD-UHFFFAOYSA-N
    • CoproporphyrinIII
    • SCHEMBL21940536
    • Q27103223
    • HT9
    • 3-[9,15,19-tris(2-carboxyethyl)-5,10,14,20-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3),?.1?,(1)(1).1(1)(3),(1)?]tetracosa-1,3(24),4,6,8,10,12,14,16,18(21),19-undecaen-4-yl]propanoic acid
    • 3-[10,15,20-tris(2-carboxyethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3),?.1?,(1)(1).1(1)(3),(1)?]tetracosa-1,3,5,7,9,11,13(22),14,16,18(21),19-undecaen-4-yl]propanoic acid
    • 1ST170012
    • MDL: MFCD06804602
    • Inchi: 1S/C36H38N4O8/c1-17-21(5-9-33(41)42)29-14-27-19(3)22(6-10-34(43)44)30(39-27)15-28-20(4)24(8-12-36(47)48)32(40-28)16-31-23(7-11-35(45)46)18(2)26(38-31)13-25(17)37-29/h13-16,38,40H,5-12H2,1-4H3,(H,41,42)(H,43,44)(H,45,46)(H,47,48)/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-
    • InChI Key: XNBNKCLBGTWWSD-UJJXFSCMSA-N
    • SMILES: OC(CCC1C(C)=C2C=C3C(CCC(=O)O)=C(C)C(C=C4C(CCC(=O)O)=C(C)C(C=C5C(C)=C(CCC(=O)O)C(=CC=1N2)N5)=N4)=N3)=O |t:8,19,30,40|

Computed Properties

  • Exact Mass: 726.22200
  • Monoisotopic Mass: 654.269
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 8
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 50
  • Rotatable Bond Count: 12
  • Complexity: 1170
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 6
  • Topological Polar Surface Area: 207
  • XLogP3: 2.6

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.4±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 1258.0±65.0 °C at 760 mmHg
  • Flash Point: 714.6±34.3 °C
  • Refractive Index: 1.638
  • Solubility: 生物體外In Vitro:DMSO溶解度≥ 83.3 mg/mL(127.23 mM)*"≥" means soluble可溶, but saturation unknown溶解度未知.
  • PSA: 205.50000
  • LogP: 4.69760
  • Solubility: Not determined
  • Vapor Pressure: 0.0±0.3 mmHg at 25°C

21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetramethyl- Pricemore >>

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