2-(methoxycarbonyl)-6-nitrobenzoic acid

Basic Information

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CAS Number

21606-04-2

Molecular Formula

C9H7NO6

Molecular Weight

225.15 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

Physical State

Powder

Melting Point

160.0 to 164.0 deg-C

Boiling Point

409.2°C at 760 mmHg

SMILES

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

InChI

InChI=1S/C9H7NO6/c1-16-9(13)5-3-2-4-6(10(14)15)7(5)8(11)12/h2-4H,1H3,(H,11,12)

InChIKey

DJMQLZPEBHSABD-UHFFFAOYSA-N

LogP

1.60280

Complexity

310

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

A4643
AM84761
SY025404
DJMQLZPEBHSABD-UHFFFAOYSA-N
EN300-1626394
CS-W013046
M2795
1,2-BENZENEDICARBOXYLIC ACID, 3-NITRO-1-METHYL ESTER
21606-04-2
DS-16336
FT-0656679
MFCD00034781
AC-4830
2-(methoxycarbonyl)-6-nitrobenzoic acid
SCHEMBL2598194
1-METHYL 3-NITROPHTHALATE
AKOS002268896
3-Nitrophthalic acid 1-methyl ester
2-Nitro-6-methoxycarbonyl benzoic acid
DTXSID30402851
1-Methyl-3-nitrophthalate
3-Nitro-phthalic acid 1-Methyl ester
Methyl 2-carboxy-3-nitrobenzoate
2-(Methoxycarbonyl)-6-nitrobenzoicAcid
3-Nitro-1,2-Benzenedicarboxylic Acid Monomethyl Ester
2-methoxycarbonyl-6-nitrobenzoic acid
2-(Methoxycarbonyl)-6-nitrobenzoic acid
methyl 3-nitro-2-carboxyl benzoate
1-Methyl 3-nitrophthalate
2-Nitro-6-methoxycarbonyl benzoic acid
1,2-Benzenedicarboxylicacid,3-nitro-1-methylester

MDL Number

MFCD00034781

Customs Code

2918990090

FAQ

What regulatory guidelines apply to 2-(methoxycarbonyl)-6-nitrobenzoic acid (CAS: 21606-04-2)?

2-(methoxycarbonyl)-6-nitrobenzoic acid (CAS: 21606-04-2) falls under the classification of organic acids and is subject to regulatory guidelines such as the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the EU, and FDA/EPA requirements for chemical substances. Specific handling, storage, and disposal procedures must comply with these regulations to ensure safety and environmental protection.

Are there alternatives to 2-(methoxycarbonyl)-6-nitrobenzoic acid (CAS: 21606-04-2) in synthesis?

Several alternatives can be used in the synthesis of 2-(methoxycarbonyl)-6-nitrobenzoic acid (CAS: 21606-04-2), such as 2-(ethoxycarbonyl)-6-nitrobenzoic acid and 2-(propoxycarbonyl)-6-nitrobenzoic acid. These alternatives can serve as viable substitutes depending on the specific reaction conditions and desired product properties. Common reagents like methyl chloroformate and ethyl chloroformate can be used as more accessible starting materials.

What is the market or research trend for 2-(methoxycarbonyl)-6-nitrobenzoic acid (CAS: 21606-04-2)?

The market for 2-(methoxycarbonyl)-6-nitrobenzoic acid (CAS: 21606-04-2) is currently stable, with increasing research interest in its applications in pharmaceutical and industrial processes. Recent trends indicate growing demand due to its use in the synthesis of various medicines and as an intermediate in chemical reactions. Further research is exploring its potential in new applications and formulations.

How should waste containing 2-(methoxycarbonyl)-6-nitrobenzoic acid (CAS: 21606-04-2) be handled?

Waste containing 2-(methoxycarbonyl)-6-nitrobenzoic acid (CAS: 21606-04-2) should be collected and disposed of according to local and international hazardous waste regulations. Proper waste management includes neutralization of acidic or alkaline solutions, followed by incineration or professional waste disposal services. Environmental precautions should include the use of appropriate protective equipment and monitoring of waste disposal processes to prevent environmental contamination.