Acetophenone, 2-nitrilo-3,4,5-trimethoxy-

Suppliers

Names

[ Name ]:
Acetophenone, 2-nitrilo-3,4,5-trimethoxy-

[Synonym ]:
2-Nitrilo-3',4',5'-trimethoxyacetophenone
3.4.5-Trimethoxy-phenylglyoxylsaeure-nitril
3,4,5-Trimethoxy-benzoylcyanid
3,4,5-Trimethoxyphenylglyoxylonitril
ACETOPHENONE,2-NITRILO-3',4',5'-TRIMETHOXY

Chemical & Physical Properties

[ Density]:
1.187g/cm3

[ Boiling Point ]:
354.7ºC at 760 mmHg

[ Molecular Formula ]:
C₁₁H₁₁NO₄

[ Molecular Weight ]:
221.20900

[ Flash Point ]:
154.9ºC

[ Exact Mass ]:
221.06900

[ PSA ]:
68.55000

[ LogP ]:
1.41868

[ Index of Refraction ]:
1.515

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AM9550000

CHEMICAL NAME :: Acetophenone, 2-nitrilo-3',4',5'-trimethoxy-

CAS REGISTRY NUMBER :: 5955-75-9

BEILSTEIN REFERENCE NO. :: 2699129

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H11-N-O4

MOLECULAR WEIGHT :: 221.23

WISWESSER LINE NOTATION :: NCVR CO1 DO1 EO1

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 :: 65 mg/kg

TOXIC EFFECTS :: Behavioral - altered sleep time (including change in righting reflex)

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 7,178,1964

Safety Information

[ HS Code ]:
2926909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Copper cyanide
Trimethylgalloyl chloride
HYDROGEN CYANIDE
Trimethylgallic acid

DownStream

3,4,5-Trimethoxybenzaldehyde
3,4,5-trimethoxyphenylacetonitrile
ETHYL 3,4,5-TRIMETHOXYBENZOYLFORMATE
Trimethylgallic acid
OXO(3,4,5-TRIMETHOXYPHENYL)ACETIC ACID
(3,4,5-trimethoxy-phenyl)-glyoxylic acid amide

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Related Compounds

3-oxo-2-(3,4,5-trimethoxy-2-nitro-benzoyl)-butyric acid ethyl ester
6-BROMO-2-(3,4,5-TRIMETHOXY-PHENYL)-QUINOLINE-4-CARBOXYLICACID
3-oxo-2-(3,4,5-trimethoxy-benzoyl)-butyric acid ethyl ester
(1R,2S)-2-(3,4,5-Trimethoxy-phenyl)-1,2-dihydro-4,6-dioxa-cyclobuta[f]indene-1-carbonitrile
trans-6-[2-(3,4,5-trimethoxy-phenyl)-vinyl]-benzofuran-4-ol
n-hydroxy-2-(3,4,5-trimethoxy-phenyl)-acetamidine
Benzofuran-2-yl(4-(6-(4-ethoxyphenyl)pyridazin-3-yl)piperazin-1-yl)methanone
6-(4-(Hydroxymethyl)piperidin-1-yl)nicotinic acid
Benzo[c][1,2,5]thiadiazol-5-yl(4-(6-(4-ethoxyphenyl)pyridazin-3-yl)piperazin-1-yl)methanone
(E)-1-(4-(6-(benzo[d][1,3]dioxol-5-yl)pyridazin-3-yl)piperazin-1-yl)-3-(4-fluorophenyl)prop-2-en-1-one
1-(4-(6-(Benzo[d][1,3]dioxol-5-yl)pyridazin-3-yl)piperazin-1-yl)-3-(3,5-dimethylisoxazol-4-yl)propan-1-one
(E)-1-(4-(6-(benzo[d][1,3]dioxol-5-yl)pyridazin-3-yl)piperazin-1-yl)-3-(thiophen-2-yl)prop-2-en-1-one
(4-(6-(Benzo[d][1,3]dioxol-5-yl)pyridazin-3-yl)piperazin-1-yl)(5-methylisoxazol-3-yl)methanone
2-(2-oxo-2-(4-(6-(o-tolyl)pyridazin-3-yl)piperazin-1-yl)ethyl)pyridazin-3(2H)-one
(1-(Methylsulfonyl)piperidin-4-yl)(4-(6-(o-tolyl)pyridazin-3-yl)piperazin-1-yl)methanone
2-methyl-6-(4-(6-(o-tolyl)pyridazin-3-yl)piperazine-1-carbonyl)pyridazin-3(2H)-one

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.