3-(Hydroxymethyl)-3-nitro-1-(4-octylphenyl)-1,4-butanediol

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Names

[ CAS No. ]:
899822-99-2

[ Name ]:
3-(Hydroxymethyl)-3-nitro-1-(4-octylphenyl)-1,4-butanediol

[Synonym ]:
3-(Hydroxymethyl)-3-nitro-1-(4-octylphenyl)-1,4-butanediol
1-Hydroxy-3-nitrodeamino Fingolimod
1,4-Butanediol, 3-(hydroxymethyl)-3-nitro-1-(4-octylphenyl)-
3-(hydroxymethyl)-3-nitro-1-(4-octylphenyl)-Ben

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
556.1±50.0 °C at 760 mmHg

[ Molecular Formula ]:
C19H31NO5

[ Molecular Weight ]:
353.453

[ Flash Point ]:
217.7±18.6 °C

[ Exact Mass ]:
353.220215

[ PSA ]:
106.51000

[ LogP ]:
5.84

[ Vapour Pressure ]:
0.0±1.6 mmHg at 25°C

[ Index of Refraction ]:
1.543

Safety Information

[ Hazard Codes ]:
Xi

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Formaldehyde
  • 3-Nitro-1-(4-octylphenyl)-1-propanone
  • 3-nitro-1-(4-octylphenyl)propyl acetate

DownStream

  • Fingolimod

Related Compounds

  • N-(2,6-dimethylphenyl)-2-(2-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)thiazol-4-yl)acetamide
  • N-(3,5-dimethylphenyl)-2-(2-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)thiazol-4-yl)acetamide
  • N-(3,4-dimethoxyphenyl)-2-(2-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)thiazol-4-yl)acetamide
  • N-(2,4-dimethoxyphenyl)-2-(2-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)thiazol-4-yl)acetamide
  • N-(2,5-dimethoxyphenyl)-2-(2-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)thiazol-4-yl)acetamide
  • 2-(4-Ethylpiperazin-1-yl)benzo[d]thiazol-6-yl 3-chlorobenzo[b]thiophene-2-carboxylate
  • N-(benzo[d][1,3]dioxol-5-yl)-2-(2-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)thiazol-4-yl)acetamide
  • 2-[(4-{[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]methyl}-1,3-thiazol-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
  • 2-(Piperidin-1-yl)benzo[d]thiazol-6-yl 2-(1,3-dioxoisoindolin-2-yl)acetate
  • 2,4-Pentanedione, 3,3a(2)-[1,3-phenylenebis(azo)]bis-
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