Methyl 4-methyl-3-nitrobenzoate

Basic Information

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CAS Number

7356-11-8

Molecular Formula

C9H9NO4

Molecular Weight

195.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

49.0 to 53.0 deg-C

Boiling Point

298℃ at 760 mmHg

Density

1.255

Solubility

Soluble in methanol.

SMILES

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CC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C9H9NO4/c1-6-3-4-7(9(11)14-2)5-8(6)10(12)13/h3-5H,1-2H3

InChIKey

YFPBHPCMYFCRKS-UHFFFAOYSA-N

LogP

2.21300

Complexity

236

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H317 May cause an allergic skin reaction
Sensitization, Skin

Synonyms & References

English

AC-3100
4-Methyl-3-nitrobenzoicacidmethylester;Methyl 4-methyl-3-nitrobenzoate
M2146
NS00037531
YFPBHPCMYFCRKS-UHFFFAOYSA-N
4-methoxycarbonyl-2-nitrotoluene
p-Toluic acid, 3-nitro-, methyl ester
4-Methyl-3-nitrobenzoic acid methyl ester
NSC29086
BCP24488
Methyl 3-nitro-p-toluate
NSC-29086
SCHEMBL193275
Methyl 3-nitro-4-methylbenzoate
FT-0636450
DTXSID3064641
EINECS 230-886-6
EN300-192687
SP3WQE4WRB
NSC 29086
Benzoic acid, 4-methyl-3-nitro-, methyl ester
AS-8504
AKOS003238481
7356-11-8
UNII-SP3WQE4WRB
CS-W020698
SY003830
MFCD00130054
3-Nitro-p-toluic Acid Methyl Ester
Methyl 4-methyl-3-nitrobenzoate
4-Methyl-3-nitro-benzoic acid methyl ester

MDL Number

MFCD00130054

Customs Code

2916399090

FAQ

What is Methyl 4-methyl-3-nitrobenzoate (CAS: 7356-11-8)?

Methyl 4-methyl-3-nitrobenzoate (CAS: 7356-11-8) is an organic compound with the molecular formula C9H10NO3. It is a yellow or orange crystalline solid with a characteristic odor. This compound is soluble in organic solvents and has a melting point of 66-68°C.

What are the main uses of Methyl 4-methyl-3-nitrobenzoate (CAS: 7356-11-8)?

Methyl 4-methyl-3-nitrobenzoate (CAS: 7356-11-8) is primarily used as a starting material in organic synthesis, particularly in the preparation of other nitro compounds and dyes. It is also used in the production of pharmaceuticals and as a reagent in research settings.

Is Methyl 4-methyl-3-nitrobenzoate (CAS: 7356-11-8) safe?

Methyl 4-methyl-3-nitrobenzoate (CAS: 7356-11-8) is generally considered safe when handled with proper precautions. However, it should be used with care due to its volatility and potential for skin and eye irritation. Protective measures include the use of gloves, goggles, and appropriate ventilation.

How should Methyl 4-methyl-3-nitrobenzoate (CAS: 7356-11-8) be stored?

Methyl 4-methyl-3-nitrobenzoate (CAS: 7356-11-8) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. The storage temperature should be maintained below 25°C, and the container should be checked regularly for any signs of deterioration or contamination.