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Kethoxal

Kethoxal structure

Kethoxal 

structure
  • CAS No:

    27762-78-3

  • Formula:

    C6H12O4

  • Chemical Name:

    Kethoxal

  • Synonyms:

    2-Butanone,3-ethoxy-1,1-dihydroxy-;3-Ethoxy-1,1-dihydroxy-2-butanone;Kethoxal;3-Ethoxy-2-oxobutyraldehyde hydrate;Ketoxal;U 2032

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

1,1-dihydroxy-3-ethoxy-2-butanone is a butanone derivative having two hydroxy substituents at the 1-position and an ethoxy substituent at the 3-position. It has a role as an antiinfective agent. It is a butanone and an aldehyde hydrate.|Kethoxal is an agent that reacts with guanine to create a covalent adduct. In vivo, Kethoxal reacts with 30S ribosomal subunits yielding inactive ribosomes.

Kethoxal Basic Attributes

148.15700

148.16

C83855

Characteristics

66.76000

-0.70880

Clear yellow to orange-yellow liquid

1.168 g/cm3

<25 °C

145 °C

99.5ºC

1.458

0.00415mmHg at 25°C

Safety Information

|Warning|H341 (100%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]|P201, P202, P281, P308+P313, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

Agents used in the prophylaxis or therapy of VIRUS DISEASES. Some of the ways they may act include preventing viral replication by inhibiting viral DNA polymerase; binding to specific cell-surface receptors and inhibiting viral penetration or uncoating; inhibiting viral protein synthesis; or blocking late stages of virus assembly. (See all compounds classified as Antiviral Agents.)

3-ethoxy-1,1-dihydroxy-2-butanone

Computed Properties

Molecular Weight:148.16
XLogP3:-0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:148.07355886
Monoisotopic Mass:148.07355886
Topological Polar Surface Area:66.8
Heavy Atom Count:10
Complexity:110
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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