3,4-Dimethoxyphenylacetone

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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

  • Methyleugenol
  • Benzene,1,2-dimethoxy-4-(2-nitro-1-propen-1-yl)-
  • METHYLMAGNESIUM BROMIDE
  • veratraldehyde
  • α-(3,4-dimethoxyphenyl)-α-(methylthio)acetone
  • 3-Oxo-4-(3,4-dimethoxy-phenyl)-buttersaeure-methylester
  • 4-Bromoveratrole
  • Acetone
  • 23EPOXYEUGENOLMETHYLETHER

DownStream

  • 1-(3,4-Dimethoxyphenyl)-2-propanol
  • Veratric acid
  • Tofisopam
  • 5-Methyl-5-veratrylhydantoin
  • alpha-Asarone
  • 3,4-Dimethoxybenzyl Alcohol
  • terameprocol
  • (S)-1-(3,4-Dimethoxyphenyl)-2-propanol
  • 2-[(3,4-dimethoxyphenyl)methyl]-2-methyl-1,3-dioxolane
  • 6,7-dimethoxy-4a-methyl-3,4,9,10-tetrahydrophenanthren-2-one

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)


More Articles

Related Compounds

  • 6-benzoyl-3,4-dimethoxyphenylacetone
  • 3-[(4-chlorophenyl)methyl]-1,3-thiazolidine-2,4-dione
  • 3-[4-(dimethylamino)phenyl]-1,5-diphenylpentane-1,5-dione
  • 3-(4,4-diphenylpiperidin-1-yl)propyl 3-aminobut-2-enoate
  • 3-(4-methoxyphenyl)prop-1-ynyl-trimethylsilane
  • 3,4-dinitro-2-oxido-1,2,5-oxadiazol-2-ium