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Substance Name: Propatyl nitrate [USAN]
RN: 2921-92-8
UNII: AJT2YN495R
InChIKey: YZZCJYJBCUJISI-UHFFFAOYSA-N

Classification Code

  • Vasodilator (Coronary)

Molecular Formula

  • C6-H11-N3-O9

Molecular Weight

  • 269.165
 
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Names and Synonyms

Name of Substance

  • Propatyl nitrate
  • Propatyl nitrate [USAN]
  • Propatylnitrate [INN]

Synonyms

  • 1,3-Propanediol, 2-ethyl-2-((nitrooxy)methyl)-, dinitrate (ester)
  • 2-Ethyl-2-(hydroxymethyl)-1,3-propanediol trinitrate
  • EINECS 220-866-5
  • Etrynit
  • ETTN
  • Propatilnitrato
  • Propatilnitrato [INN-Spanish]
  • Propatyl nitrate
  • Propatylnitrate
  • Propatylnitratum
  • Propatylnitratum [INN-Latin]
  • UNII-AJT2YN495R
  • Win 9317

Systematic Names

  • 1,3-Propanediol, 2-ethyl-2-((nitrooxy)methyl)-, dinitrate (ester)
  • Propatylnitrate

Registry Numbers

CAS Registry Number

  • 2921-92-8

FDA UNII

  • AJT2YN495R

System Generated Number

  • 0002921928

Structure Descriptors

InChI

1S/C6H11N3O9/c1-2-6(3-16-7(10)11,4-17-8(12)13)5-18-9(14)15/h2-5H2,1H3

InChIKey

YZZCJYJBCUJISI-UHFFFAOYSA-N

Smiles

[N+]([O-])(OCC(CC)(CO[N+]([O-])=O)CO[N+]([O-])=O)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 51.5 deg C   EXP
log P (octanol-water) 2.950 (none)   EST
Atmospheric OH Rate Constant 2.53E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.