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Substance Name: Acetamidomalonic acid diethyl ester
RN: 1068-90-2
UNII: 4VDX81E00W
InChIKey: ISOLMABRZPQKOV-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C9-H15-N-O5

Molecular Weight

  • 217.2195
 
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Names and Synonyms

Name of Substance

  • Acetamidomalonic acid diethyl ester
  • Diethyl acetamidomalonic acid

Synonyms

  • (Acetylamino)propanedioic acid diethyl ester
  • 4-04-00-02993 (Beilstein Handbook Reference)
  • Acetamidomalonic acid diethyl ester
  • AI3-52334
  • BRN 0783883
  • Diethyl 2-acetamidomalonate
  • Diethyl acetamidomalonate
  • Diethyl acetaminomalonate
  • Diethyl acetylaminomalonate
  • Diethylester kyseliny acetylaminomalonove
  • Diethylester kyseliny acetylaminomalonove [Czech]
  • EINECS 213-952-9
  • Ethyl acetamidomalonate
  • HSDB 2664
  • Malonic acid, acetamido-, diethyl ester
  • NSC 7645
  • Propanedioic acid, (acetylamino)-, diethyl ester
  • UNII-4VDX81E00W

Systematic Names

  • Diethyl acetamidomalonate
  • Malonic acid, acetamido-, diethyl ester
  • Propanedioic acid, (acetylamino)-, diethyl ester
  • Propanedioic acid, 2-(acetylamino)-, 1,3-diethyl ester

Registry Numbers

CAS Registry Number

  • 1068-90-2

FDA UNII

  • 4VDX81E00W

System Generated Number

  • 0001068902

Structure Descriptors

InChI

1S/C9H15NO5/c1-4-14-8(12)7(10-6(3)11)9(13)15-5-2/h7H,4-5H2,1-3H3,(H,10,11)

InChIKey

ISOLMABRZPQKOV-UHFFFAOYSA-N

Smiles

CCOC(=O)C(C(=O)OCC)NC(=O)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 96.3 deg C   EXP
log P (octanol-water) -0.210 (none)   EST
Atmospheric OH Rate Constant 9.69E-12 cm3/molecule-sec 25 EST

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