Cas no 83519-04-4 (Ilmofosine)

Ilmofosine structure
Ilmofosine structure
Product Name:Ilmofosine
CAS No:83519-04-4
MF:C26H56NO5PS
MW:525.765308380127
CID:725008
PubChem ID:24724510
Update Time:2025-04-19

Ilmofosine Chemical and Physical Properties

Names and Identifiers

    • 3,5-Dioxa-9-thia-4-phosphapentacosan-1-aminium,4-hydroxy-7-(methoxymethyl)-N,N,N-trimethyl-, inner salt, 4-oxide
    • ILMOFOSINE
    • 1-Hexadecylmercapto-2-methoxymethyl-3-propyl phosphoric acid monocholine ester
    • BM 41.440
    • UNII-5ZZK34MC3V
    • MFCD00869023
    • Ilmofosina [Spanish]
    • [2-(hexadecylsulfanylmethyl)-3-methoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
    • D04504
    • Ilmofosinum
    • Ilmofosina
    • SH-MM-lysolecithin
    • starbld0005535
    • 3,5-DIOXA-9-THIA-4-PHOSPHAPENTACOSAN-1-AMINIUM, 4-HYDROXY-7-(METHOXYMETHYL)-N,N,N-TRIMETHYL-, INNER SALT, 4-OXIDE
    • Ilmofosine, >=97% (NMR), semisolid (waxy)
    • Ilmofosine [USAN:INN]
    • ILMOFOSINE [INN]
    • ILMOFOSINE [MART.]
    • Tox21_113506
    • (+/-)-ILMOFOSINE
    • 3,5-Dioxa-9-thia-4-phosphapentacosan-1-aminium, 4-hydroxy-7-(methoxymethyl)-N,N,N-trimethyl-, (2S-(1(R*(R*)),2alpha,3abeta,7abeta))-
    • 1-hexadecylmercapto-2-methoxymethyl-3-propylphosphoric acid monocholine ester
    • 5ZZK34MC3V
    • BM-41440
    • 3,5-DIOXA-9-THIA-4-PHOSPHAPENTACOSAN-1-AMINIUM, 4-HYDROXY-7-(METHOXYMETHYL)-N,N,N-TRIMETHYL-, HYDROXIDE, INNER SALT, 4-OXIDE, (+/-)-
    • Ilmofosine [USAN]
    • 1-Hexadecylthio-2-methoxymethyl-rac-glycero-3-phosphocholine
    • DTXCID7028934
    • SCHEMBL48829
    • 3-(hexadecylthio)-2-(methoxymethyl)propyl 2-(trimethylammonio)ethyl phosphate
    • 3-(Hexadecylthio)-2-(methoxymethyl)propyl (2-(trimethylammonio)ethyl) phosphate
    • BM 41440
    • NSC601679
    • 3,5-Dioxa-9-thia-4-phosphapentacosan-1-aminium, 4-hydroxy-7-(methoxymethyl)-N,N,N-trimethyl-,hydroxide, inner salt, 4-oxide
    • Q27263125
    • NS00123984
    • BM-41.440
    • CHOLINE HYDROXIDE, (+/-)-3-(HEXADECYLTHIO)-2-(METHOXYMETHYL)PROPYL HYDROGEN PHOSPHATE, INNER SALT
    • (+-)-Ilmofosine
    • BRN 4767637
    • DTXSID2049008
    • CAS-83519-04-4
    • NSC-601679
    • Thio ALP
    • Ilmofosinum [Latin]
    • NCGC00165808-01
    • Ilmofosine (USAN/INN)
    • 83519-04-4
    • CHEMBL28930
    • GLXC-25058
    • BM41-440
    • Ilmofosine
    • MDL: MFCD00869023
    • Inchi: 1S/C26H56NO5PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-34-25-26(23-30-5)24-32-33(28,29)31-21-20-27(2,3)4/h26H,6-25H2,1-5H3
    • InChI Key: ODEDPKNSRBCSDO-UHFFFAOYSA-N
    • SMILES: S(CC(COC)COP(=O)([O-])OCC[N+](C)(C)C)CCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 525.36168206g/mol
  • Monoisotopic Mass: 525.36168206g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 34
  • Rotatable Bond Count: 26
  • Complexity: 482
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 7.5
  • Topological Polar Surface Area: 93.1?2

Experimental Properties

  • Solubility: H2O: soluble10mg/mL

Ilmofosine Security Information

  • Symbol: GHS06
  • Signal Word:Danger
  • Hazard Statement: H301
  • Warning Statement: P301+P310
  • Hazardous Material transportation number:UN 2811 6.1 / PGIII
  • WGK Germany:3
  • Hazard Category Code: 22
  • RTECS:JH4758000
  • Hazardous Material Identification: Xn
  • Storage Condition:?20°C

Ilmofosine Pricemore >>

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