3,4-Dimethoxyphenylacetone

Names

[ CAS No. ]:
776-99-8

[ Name ]:
3,4-Dimethoxyphenylacetone

[Synonym ]:
1-(3,4-Dimethoxyphenyl)acetone
2-Propanone, 1-(3,4-dimethoxyphenyl)-
1-(3,4-dimethoxyphenyl)propan-2-one
3,4-Dimethoxyphenylacetone
MFCD00008772
EINECS 212-285-0

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
281.8±25.0 °C at 760 mmHg

[ Molecular Formula ]:
C₁₁H₁₄O₃

[ Molecular Weight ]:
194.227

[ Flash Point ]:
115.0±9.6 °C

[ Exact Mass ]:
194.094299

[ PSA ]:
35.53000

[ LogP ]:
1.18

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.497

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UC1795500

CHEMICAL NAME :: 2-Propanone, 1-(3,4-dimethoxyphenyl)-

CAS REGISTRY NUMBER :: 776-99-8

BEILSTEIN REFERENCE NO. :: 1107410

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H14-O3

MOLECULAR WEIGHT :: 194.25

WISWESSER LINE NOTATION :: 1V1R CO1 DO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 670 mg/kg

TOXIC EFFECTS :: Behavioral - ataxia

REFERENCE :: JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 60,799,1971

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
UC1795500

[ HS Code ]:
2914509090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

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%

Articles

Asymmetric strecker synthesis of alpha-amino acids via a crystallization-induced asymmetric transformation using (R)-phenylglycine amide as chiral auxiliary.

Org. Lett. 3(8) , 1121-4, (2001)

[reaction: see text]. Diastereoselective Strecker reactions based on (R)-phenylglycine amide as chiral auxiliary are reported. The Strecker reaction is accompanied by an in situ crystallization-induce...

Asymmetric amination of 4-methoxyphenylacetone and its related compounds with microorganisms. Nakamichi K, et al.

Appl. Microbiol. Biotechnol. 33(6) , 637-640, (1990)

Related Compounds

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