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Substance Name: 2,3-Butanediol 1-nitrate
RN: 147794-10-3
InChIKey: CGFCSKMZZXPWEY-UHFFFAOYSA-N

Molecular Formula

  • C4-H9-N-O4

Molecular Weight

  • 135.118
 
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Names and Synonyms

  • 2,3-Butanediol 1-nitrate

Registry Numbers

CAS Registry Number

  • 147794-10-3

System Generated Number

  • 0147794103

Structure Descriptors

InChI

1S/C4H9NO4/c1-3(6)4(2)9-5(7)8/h3-4,6H,1-2H3

InChIKey

CGFCSKMZZXPWEY-UHFFFAOYSA-N

Smiles

[N+](O[C@@H]([C@@H](O)C)C)([O-])=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.620 (none)   EST
Water Solubility 2.60E+04 mg/L 25 EST
Vapor Pressure 0.209 mm Hg 25 EST
Henry's Law Constant 9.90E-08 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 2.15E-12 cm3/molecule-sec 25 EST

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