3-Acetyl-1-propanol

3-Acetyl-1-propanol Basic information

Product Name:	3-Acetyl-1-propanol
Synonyms:	4-Oxo-1-pentanol;-Acetopropanol;Acetopropyl alcohol;acetopropylalcohol;-Acetylpropanol;gamma-Acetopropanol;gamma-Acetopropyl alcohol;gamma-Acetylpropyl alcohol
CAS:	1071-73-4
MF:	C5H10O2
MW:	102.13
EINECS:	213-994-8
Product Categories:	straight chain compounds
Mol File:	1071-73-4.mol

3-Acetyl-1-propanol Chemical Properties

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.)
Fp	200 °F
storage temp.	2-8°C
pka	14.89±0.10(Predicted)
form	Liquid
color	Colorless to Light yellow to Light orange
LogP	-0.570 (est)
CAS DataBase Reference	1071-73-4(CAS DataBase Reference)
NIST Chemistry Reference	2-Pentanone, 5-hydroxy-(1071-73-4)

Safety Information

Hazard Codes	Xi
Risk Statements	36/37/38
Safety Statements	37/39-26
WGK Germany	2
RTECS	UA4600000
HS Code	29144000
Toxicity	LD50 orl-rat: 6400 mg/k TNICS* 13,118,73

MSDS Information

Provider	Language
5-Hydroxy-2-pentanone	English
SigmaAldrich	English
ACROS	English

3-Acetyl-1-propanol Usage And Synthesis

Chemical Properties	clear colorless liquid
Uses	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.

3-Acetyl-1-propanol Preparation Products And Raw materials

Raw materials	Sodium hydroxide-->Aluminum oxide-->Palladium chloride-->Gamma Butyrolactone-->2-Methylfuran-->PALLADIUM-CATALYSTS-->2-Methyltetrahydrofuran-->Nitrohydrochloric acid-->4-Pentyn-1-ol
Preparation Products	2-Methyltetrahydrofuran-->2-chloro-3-oxopentyl acetate-->THIOTHIAMINE-->5-Diethylamino-2-pentanone-->4-OXOPENTYL ACETATE-->5-BROMO-PENTAN-2-ONE-->2-Methyltetrahydrofuran-3-thiol-->4-aminopentan-1-ol-->1,4-PENTANEDIOL-->4,4'-Azobis(4-cyano-1-pentanol)

Acetyl-resveratrol Methyl cyclopentenolone N-ACETYL-L-TYROSINE ETHYL ESTER 1,3-Acetonedicarboxylic acid N-Acetyl-L-cysteine Mesityl oxide 3-(4-METHOXYBENZOYL)PROPIONIC ACID Acetylacetone Acetylferrocene tributyl acetocitrate Acetyl chloride Acetyl coenzyme A sodium salt 4'-Hydroxyacetophenone 3-Acetyl-1-propanol Cyclopentanone 2-Pentanone CHLOROPHOSPHONAZO III 1-Propanol

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