Cas no 163894-00-6 (21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetrakis(carboxymethyl)-b2(b7-,b12 or b18)-hydroxy-)

21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetrakis(carboxymethyl)-b2(b7-,b12 or b18)-hydroxy- structure
163894-00-6 structure
Product Name:21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetrakis(carboxymethyl)-b2(b7-,b12 or b18)-hydroxy-
CAS No:163894-00-6
MF:C3H6O3
MW:90.0779414176941
CID:110378
PubChem ID:19789253
Update Time:2025-04-18

21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetrakis(carboxymethyl)-b2(b7-,b12 or b18)-hydroxy- Chemical and Physical Properties

Names and Identifiers

    • 21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetrakis(carboxymethyl)-b2(b7-,b12 or b18)-hydroxy-
    • b-Hydroxypropionic acid
    • 21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetrakis(carboxymethyl)-b2(b7-,b12 or...
    • 163894-00-6
    • hydron;2-hydroxypropanoate
    • Inchi： 1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)
    • InChI Key： JVTAAEKCZFNVCJ-UHFFFAOYSA-N
    • SMILES： OC(C(=O)[O-])C.[H+]

Computed Properties

  • Exact Mass: 90.03168
  • Monoisotopic Mass: 90.031694049g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 6
  • Rotatable Bond Count: 0
  • Complexity: 53.5
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 60.4?2

Experimental Properties

  • Density: 1.276
  • Boiling Point: 227.6°Cat760mmHg
  • Flash Point: 109.9°C
  • Refractive Index: 1.451
  • PSA: 57.53

21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetrakis(carboxymethyl)-b2(b7-,b12 or b18)-hydroxy- Related Literature

163894-00-6 (21H,23H-Porphine-2,7,12,18-tetrapropanoicacid, 3,8,13,17-tetrakis(carboxymethyl)-b2(b7-,b12 or b18)-hydroxy-) Related Products

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