Methyl 2-(bromomethyl)-5-nitrobenzoate

Basic Information

View in Editor

CAS Number

90725-68-1

Molecular Formula

C9H8BrNO4

Molecular Weight

274.07 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

397.3°C at 760 mmHg

SMILES

View in Editor

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])CBr

InChI

InChI=1S/C9H8BrNO4/c1-15-9(12)8-4-7(11(13)14)3-2-6(8)5-10/h2-4H,5H2,1H3

InChIKey

OAEABYNRBPCSQB-UHFFFAOYSA-N

LogP

2.79950

Complexity

253

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Methyl 2-(bromomethyl)-5-nitrobenzoate
Methyl 2-bromomethyl-5-nitrobenzoate
o-Toluicacid, a-bromo-5-nitro-, methyl ester(7CI)
Methyl 2-bromomethyl-5-nitro-benzoate
PubChem23500
methyl 2-(bromomethyl)-5-nitro-benzoate
OAEABYNRBPCSQB-UHFFFAOYSA-N
Methyl 6-Bromomethyl-3-nitrobenzoate
AB18048
BC004936
ST2419487
AX8029874
Z5318
2-bromomethyl-5-ni
o-Toluic acid, α-bromo-5-nitro-, methyl ester (7CI)
EC2-053
methyl 2-(bromomethyl)-5-nitrobenzoate
J-521974
DB-078785
METHYL 2-BROMOMETHYL-5-NITROBENZOATE
DTXSID60561622
Methyl2-(bromomethyl)-5-nitrobenzoate
2-bromomethyl-5-nitrobenzoic acid methyl ester
CS-D0234
MFCD04114313
SCHEMBL1318195
AKOS016004579
90725-68-1
DS-11190

MDL Number

MFCD04114313

FAQ

What regulatory guidelines apply to Methyl 2-(bromomethyl)-5-nitrobenzoate (CAS: 90725-68-1)?

Methyl 2-(bromomethyl)-5-nitrobenzoate (CAS: 90725-68-1) is subject to GHS classification for hazardous chemicals, including health and environmental hazards. It falls under the scope of REACH regulations in the European Union, requiring registration for substances above a certain tonnage. FDA and EPA may also have specific requirements for its use and disposal in the United States, such as reporting under the Toxic Substances Control Act (TSCA).

Are there alternatives to Methyl 2-(bromomethyl)-5-nitrobenzoate (CAS: 90725-68-1) in synthesis?

Alternative reagents such as methyl 2-chloromethyl-5-nitrobenzoate or methyl 2-(iodomethyl)-5-nitrobenzoate can be used as substitutes in certain synthesis processes. However, the choice of alternative depends on the specific reaction conditions and the desired properties of the final product.

What is the market or research trend for Methyl 2-(bromomethyl)-5-nitrobenzoate (CAS: 90725-68-1)?

The market for Methyl 2-(bromomethyl)-5-nitrobenzoate (CAS: 90725-68-1) reflects a steady demand in pharmaceutical and fine chemical industries. Research trends indicate increasing focus on its use in drug synthesis and as a precursor in organic synthesis. Price trends show fluctuations due to supply chain factors, with a growing emphasis on sustainable and eco-friendly production methods.

How should waste containing Methyl 2-(bromomethyl)-5-nitrobenzoate (CAS: 90725-68-1) be handled?

Waste containing Methyl 2-(bromomethyl)-5-nitrobenzoate (CAS: 90725-68-1) should be collected in sealed, labeled containers and disposed of through professional waste disposal services. Incineration, neutralization, or chemical conversion methods may be employed, depending on local regulations. Environmental precautions include proper ventilation and personal protective equipment to prevent exposure and ensure safety during disposal.