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HomeProduct name list3-Acetyl-1-propanol

3-Acetyl-1-propanol

Synonym(s):3-Acetyl-1-propanol

  • CAS NO.:1071-73-4
  • Empirical Formula: C5H10O2
  • Molecular Weight: 102.13
  • MDL number: MFCD00002961
  • EINECS: 213-994-8
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-11-27 17:31:30
3-Acetyl-1-propanol Structural

What is 3-Acetyl-1-propanol?

Chemical properties

clear colorless liquid

The Uses of 3-Acetyl-1-propanol

3-Acetopropanol is a substrate for alcohol dehydrogenase and is an intermediate in the synthesis of Didesethyl Chloroquine (D440960), a metabolite of Chloroquine.

Synthesis Reference(s)

Journal of the American Chemical Society, 75, p. 4456, 1953 DOI: 10.1021/ja01114a018
Tetrahedron Letters, 26, p. 5713, 1985 DOI: 10.1016/S0040-4039(01)80928-X

Safety Profile

Moderately toxic by ingestion andinhalation. When heated to decomposition it emits acridsmoke.

Properties of 3-Acetyl-1-propanol

Melting point: 2.5°C (estimate)
Boiling point: 144-145 °C/100 mmHg (lit.)
Density  1.007 g/mL at 25 °C (lit.)
refractive index  n20/D 1.437(lit.)
Flash point: 200 °F
storage temp.  2-8°C
form  Liquid
pka 14.89±0.10(Predicted)
color  Colorless to Light yellow to Light orange
CAS DataBase Reference 1071-73-4(CAS DataBase Reference)
NIST Chemistry Reference 2-Pentanone, 5-hydroxy-(1071-73-4)

Safety information for 3-Acetyl-1-propanol

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H227:Flammable liquids
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P370+P378:In case of fire: Use … for extinction.
P403+P235:Store in a well-ventilated place. Keep cool.
P501:Dispose of contents/container to..…

Computed Descriptors for 3-Acetyl-1-propanol

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