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Substance Name: 4,4-Dimethoxy-2-butanone
RN: 5436-21-5
UNII: 0IZ188B2ZA
InChIKey: PJCCSZUMZMCWSX-UHFFFAOYSA-N

Molecular Formula

  • C6-H12-O3

Molecular Weight

  • 132.1578
 
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Names and Synonyms

Name of Substance

  • 4,4-Dimethoxy-2-butanone

Synonyms

  • 1,1-Dimethoxy-3-butanone
  • 2-Butanone, 4,4-dimethoxy-
  • 3-Ketobutyraldehyde dimethyl acetal
  • 3-Ketobutyraldehyde dimethylacetal
  • 3-Oxobutanal dimethyl acetal
  • 3-Oxobutyraldehyde dimethyl acetal
  • 4,4-Dimethoxy-2-butanone
  • Acetoacetaldehyde 1-(dimethyl acetal)
  • Acetoacetaldehyde dimethyl acetal
  • Acetylacetaldehyddimethylacetal
  • Acetylacetaldehyde dimethyl acetal
  • AI3-22760
  • beta-Oxobutyraldehyde dimethyl acetal
  • EINECS 226-605-1
  • FEMA No. 3381
  • Formylacetone dimethyl acetal
  • NSC 21538
  • NSC 59721
  • UNII-0IZ188B2ZA

Systematic Names

  • 2-Butanone, 4,4-dimethoxy-
  • 4,4-Dimethoxybutanone
  • Acetoacetaldehyde, 1-(dimethyl acetal) (6CI,7CI,8CI)

Superlist Name

  • 4,4-Dimethoxy-2-butanone

Registry Numbers

CAS Registry Number

  • 5436-21-5

FDA UNII

  • 0IZ188B2ZA

System Generated Number

  • 0005436215

Structure Descriptors

InChI

1S/C6H12O3/c1-5(7)4-6(8-2)9-3/h6H,4H2,1-3H3

InChIKey

PJCCSZUMZMCWSX-UHFFFAOYSA-N

Smiles

C(C(=O)C)C(OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 6200mg/kg (6200mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
National Technical Information Service. Vol. OTS0534674,