2,2-Diethoxyacetophenone

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Names

[ CAS No. ]:
6175-45-7

[ Name ]:
2,2-Diethoxyacetophenone

[Synonym ]:
MFCD00009659
2,2-Dimethoxyacetophenone
1,1-diethoxyacetophenone
PHENYLGLYOXAL DIETHYL ACETAL
2,2-diethoxy-1-phenyl-ethanon
PHENYLGLYOXAL 2-DIETHYL ACETAL
DiethoxyAcetophenone
2,2-DICHLORO-N-(1-CYANO-CYCLOPENTYL)-ACETAMIDE
EINECS 228-220-4
DEAP
2,2-DIETHOXY-1-PHENYLETHANONE

Chemical & Physical Properties

[ Density]:
1.034 g/mL at 25 °C(lit.)

[ Boiling Point ]:
131-134 °C10 mm Hg(lit.)

[ Molecular Formula ]:
C12H16O3

[ Molecular Weight ]:
208.25400

[ Flash Point ]:
>230 °F

[ Exact Mass ]:
208.11000

[ PSA ]:
35.53000

[ LogP ]:
2.26840

[ Vapour Pressure ]:
0.01 mm Hg ( 20 °C)

[ Index of Refraction ]:
n20/D 1.499(lit.)

[ Storage condition ]:
2-8°C

[ Water Solubility ]:
0.16 g/L (25 ºC)

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MD3284000
CHEMICAL NAME :
Glyoxal, phenyl-, 2-(diethyl acetal)
CAS REGISTRY NUMBER :
6175-45-7
BEILSTEIN REFERENCE NO. :
2100306
LAST UPDATED :
199710
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C12-H16-O3
MOLECULAR WEIGHT :
208.28
WISWESSER LINE NOTATION :
2OYO2&VR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
5660 uL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 28,313,1974
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
11300 uL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 28,313,1974

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R33;R36/37/38

[ Safety Phrases ]:
S23-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
MD3284000

[ HS Code ]:
2914509090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Phenylglyoxal
  • Triethyl orthoformate
  • Methyl benzoate
  • tributyl(diethoxymethyl)stannane
  • Phenyllithium
  • Ethyl diethoxyacetate
  • Acetophenone
  • Ethanol
  • Phenylacetylene

DownStream

  • (r)-(-)-2-hydroxy-2-phenylpropionic acid
  • 2,2-diethoxy-1-phenyl-ethanol
  • (±)-methyl mandelate
  • 5-Methyl-2-phenylhex-2-enal
  • (R)-1-Phenyl-1,2-ethanediol
  • styrene glycol
  • Phenylglyoxal
  • (S)-(+)-2-HYDROXY-2-PHENYLPROPIONIC ACID
  • Ethyl oxophenylacetate
  • 1-(2-Ethoxyphenyl)ethanone

Customs

[ HS Code ]: 2914509090

[ Summary ]:
HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

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Related Compounds

  • 4'-chloro-2,2-diethoxyacetophenone
  • 2-(2-aminophenyl)disulfanylaniline
  • 2-[2,2-Difluoro-1-(MEM)ethenyl]boronic acid neopentylglycol ester
  • 2-(2-Fluorophenyl)-2-(4-fluorophenyl)oxirane
  • 2-(2-chloro-5-nitrophenyl)pyridine
  • 2-[(2-chloroethyl-nitroso-carbamoyl)amino]acetamide