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Medinoterb acetate

Medinoterb acetate structure

CAS No:
2487-01-6
Formula:
C13H16N2O6
Chemical Name:
Medinoterb acetate
Synonyms:
Phenol,6-(1,1-dimethylethyl)-3-methyl-2,4-dinitro-,1-acetate;m-Cresol,6-tert-butyl-2,4-dinitro-,acetate (ester);Phenol,6-(1,1-dimethylethyl)-3-methyl-2,4-dinitro-,acetate (ester);m-Cresol,6-tert-butyl-2,4-dinitro-,acetate;MC 1488;6-tert-Butyl-2,4-dinitro-3-methylphenyl acetate;Medinoterb acetate;NSC 202551;2,4-Dinitro-3-methyl-6-tert-butylphenyl acetate
Categories:
Agrochemicals > Herbicides

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Medinoterb acetate Basic Attributes

Molecular Weight：

296.28

Exact Mass：

296.28

EC Number：

219-634-6

UNII：

ONC86O885A

NSC Number：

202551

DSSTox ID：

DTXSID50179578

HScode：

2915390090

Characteristics

PSA：

117.94000

XLogP3：

4.08060

Density：

1.267g/cm3

Melting Point：

86.5 °C

Boiling Point：

377.2ºC at 760 mmHg

Flash Point：

146.3ºC

Refractive Index：

1.545

Water Solubility：

10mg/L(room temperature)

Vapor Pressure：

6.85E-06mmHg at 25°C

Toxicity：

Oral-rat LD50: 42 mg/kg; Oral-Mouse LD50: 90 mg/kg

Flammability characteristics：

Thermal decomposition of toxic nitrogen oxide gas

Safety Information

Packing level：

Hazard category：

6.1(a)

Transport codes：

2779

hazard class code：

21-25

safety instructions：

36/37-45

RTECS Number：

AF7175000

Marks：

Storage features：

The warehouse is ventilated, low temperature and dry; stored and transported separately from food materials

Precautionary statement(s)：

P264, P270, P280, P301+P310, P302+P352, P312, P321, P322, P330, P363, P405, P501

Hazard Statements：

H301

GHS Classification：

|Danger|H301: Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P280, P301+P310, P302+P352, P312, P321, P322, P330, P363, P405, and P501|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Toxicity

Toxicity class：

most toxic

Computed Properties

Molecular Weight:296.28
XLogP3:3.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:296.10083623
Monoisotopic Mass:296.10083623
Topological Polar Surface Area:118
Heavy Atom Count:21
Complexity:433
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes