3-(Methoxycarbonyl)-5-nitrobenzoic acid

Basic Information

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CAS Number

1955-46-0

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

Melting Point

181.0 to 185.0 deg-C

SMILES

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

InChI

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

InChIKey

ZCRNIIJXDRYWDU-UHFFFAOYSA-N

LogP

1.60280

Complexity

310

Synonyms & References

English

N0641
5-nitro-isophtalic acid mono methyl ester
W-107688
MONO-METHYL-5-NITROISOPHTHALATE
5-nitro-isophthalic acid monomethyl ester
AC-11502
methyl 3-carboxy-5-nitrobenzoate
5-nitro-isophthalic acid monomethylester
Monomethyl 5-nitrobenzene-1,3-dicarboxylate
3-(Methoxycarbonyl)-5-nitrobenzoic acid #
AB00998
AKOS000119453
MFCD00009793
V8UVV7P68X
Monomethyl-5-nitroisophthalate
5-nitroisophthalic acid mono-methyl ester
mono-Methyl 5-nitroisophthalate, PESTANAL(R), analytical standard
5-Nitroisophthalic acid monomethyl ester
EINECS 217-793-6
5-nitro-isophthalic acid mono methyl ester
1955-46-0
Methyl5-nitroisophthalate
mono-Methyl 5-nitroisophthalate, 99%
3-(Methoxycarbonyl)-5-nitrobenzoic acid;5-Nitroisophthalic acid monomethyl ester;Monomethyl 5-nitroisophthalate
3-(Methoxycarbonyl)-5-nitrobenzoic acid
SCHEMBL38446
Methyl 5-nitrohydrogen.isophthalate
BCP31398
DTXSID50883784
Monomethyl 5-nitroisophthalate
3-methoxycarbonyl-5-nitro-benzoic acid

MDL Number

MFCD00009793

Customs Code

2942000000

FAQ

What is 3-(Methoxycarbonyl)-5-nitrobenzoic acid (CAS: 1955-46-0)?

3-(Methoxycarbonyl)-5-nitrobenzoic acid is an organic compound with the formula C9H7NO5. It is a white crystalline solid with a pungent odor. This compound is characterized by its acidic nature and the presence of a nitro group and a methoxycarbonyl group in its structure.

What are the main uses of 3-(Methoxycarbonyl)-5-nitrobenzoic acid (CAS: 1955-46-0)?

3-(Methoxycarbonyl)-5-nitrobenzoic acid is primarily used in the synthesis of pharmaceuticals and as an intermediate in chemical reactions. It also finds applications in the preparation of other organic compounds and in some analytical procedures.

Is 3-(Methoxycarbonyl)-5-nitrobenzoic acid (CAS: 1955-46-0) safe?

3-(Methoxycarbonyl)-5-nitrobenzoic acid is generally considered safe for handling when proper precautions are taken. It is corrosive and may cause skin irritation. Adequate protective measures, such as the use of gloves and goggles, are recommended. It is not considered toxic by ingestion, but exposure to the skin or eyes should be avoided. Follow safety guidelines and use appropriate safety equipment.

How should 3-(Methoxycarbonyl)-5-nitrobenzoic acid (CAS: 1955-46-0) be stored?

3-(Methoxycarbonyl)-5-nitrobenzoic acid should be stored in tightly sealed containers to protect it from moisture and air. Store it in a cool, dry place away from direct sunlight and heat sources. The ideal storage temperature is below 25°C (77°F). Humidity should be kept low to prevent the compound from absorbing moisture, which could affect its stability. Avoid storing it near incompatible materials such as strong acids or bases.