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Substance Name: Diprogulic acid [INN]
RN: 18467-77-1
UNII: 3981541LXD
InChIKey: FWCBATIDXGJRMF-FLNNQWSLSA-N

Molecular Formula

  • C12-H18-O7

Molecular Weight

  • 274.2672
 
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Names and Synonyms

Name of Substance

  • Dikegulac
  • Dikegulac [BSI:ISO]
  • Diprogulic acid [INN]

Synonyms

  • 2,3,4,6-bis-O-(1-Methylethylidene)-alpha-L-xylo-2-hexulofuranosonic acid (9CI)
  • 2,3,4,6-di-O-Isopropylidene-alpha-L-xylo-2-hexulofuranosonic acid
  • 2,3:4,6-Diacetone-2-keto-L-gulonic acid
  • Acide diprogulique
  • Acide diprogulique [INN-French]
  • Acido diprogulico
  • Acido diprogulico [INN-Spanish]
  • Acidum diprogulicum
  • Acidum diprogulicum [INN-Latin]
  • Diacetone-2-keto-1-gulonic acid
  • Diprogulic acid
  • EINECS 242-348-8
  • UNII-3981541LXD

Systematic Names

  • 2,3:4,6-Di-O-isopropylidene-alpha-L-xylo-hexulofuranosonic acid
  • alpha-L-xylo-2-Hexulofuranosonic acid, 2,3:4,6-bis-O-(1-methylethylidene)-
  • Diprogulic acid

Registry Numbers

CAS Registry Number

  • 18467-77-1

FDA UNII

  • 3981541LXD

Other Registry Numbers

  • 1253699-69-2
  • 129607-69-8
  • 131400-21-0
  • 136881-53-3
  • 26996-98-5
  • 27708-72-1
  • 28300-95-0
  • 36058-05-6
  • 3768-13-6
  • 49813-52-7
  • 56225-64-0
  • 56288-61-0
  • 59795-40-3
  • 64040-42-2
  • 72349-14-5

System Generated Number

  • 0018467771

Structure Descriptors

InChI

1S/C12H18O7/c1-10(2)15-5-6-7(17-10)8-12(16-6,9(13)14)19-11(3,4)18-8/h6-8H,5H2,1-4H3,(H,13,14)/t6-,7+,8-,12+/m0/s1

InChIKey

FWCBATIDXGJRMF-FLNNQWSLSA-N

Smiles

CC1(C)OC[C@@H]2O[C@]3(OC(C)(C)O[C@H]3[C@@H]2O1)C(=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 74 deg C   EXP
log P (octanol-water) 1.35 (none)   EXP
Vapor Pressure 2.82E-06 mm Hg 25 EST
Henry's Law Constant 1.90E-16 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.32E-11 cm3/molecule-sec 25 EST

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