5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid

Basic Information

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CAS Number

253870-02-9

Molecular Formula

C8H9NO3

Molecular Weight

167.16 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Physical State

Pale-yellow to Yellow-brown Solid

Melting Point

283°C

Boiling Point

374.9 oC at 760 mmHg

Density

1.343

Water Solubility

Slightly soluble in water.

Flash Point

180.5℃

Refractive Index

1.625

SMILES

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CC1=C(NC(=C1C(=O)O)C)C=O

InChI

InChI=1S/C8H9NO3/c1-4-6(3-10)9-5(2)7(4)8(11)12/h3,9H,1-2H3,(H,11,12)

InChIKey

YCIHQDVIAISDPS-UHFFFAOYSA-N

LogP

1.14224

Topological Polar Surface Area

70.16 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

205

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

DTXSID10454191
5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid, AldrichCPR
PB23434
BCP00875
CS-W003265
A5126
SCHEMBL394139
Z1201623378
EN300-143759
Q-101343
5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic
3,5-dimethyl-2-formylindole-4-carboxylic acid
5-formyl-2,4-dimethyl-1H-pyrrole-3-formic acid
MFCD06202342
5-Formyl-2 pound not4-dimethyl-1H-pyrrole-3-carboxylicacid
3,5-dimethyl-2-formyl-1h-pyrrole-4-carboxylic acid
FT-0602120
253870-02-9
5-Formyl-2,4-dimethyl-3-pyrrolecarboxylic Acid
5-formyl-2,4-dimethyl-1H-pyrrole-3- carboxylic acid
5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic Acid
SY017130
L-(+)-Tartaricacid
AC-1744
1H-PYRROLE-3-CARBOXYLIC ACID, 5-FORMYL-2,4-DIMETHYL-
3Y-0054
F0939
2,4-dimethyl-5-formylpyrrole-3-carboxylic acid
1H-Pyrrole-3-carboxylic acid, 5-formyl-2,4-dimethyl-; 5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid; 2,4-Dimethyl-5-formyl-1H-pyrrole-3-carboxylic acid; 2,4-Dimethyl-5-formylpyrrole-3-carboxylic acid; 5-Formyl-2,4-dimethylpyrrole-3-carboxylic acid
5-FORMYL-2,4-DIMETHYLPYRROLE-3-CARBOXYLIC ACID
AM20090638

MDL Number

MFCD06202342

FAQ

What is 5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (CAS: 253870-02-9)?

5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (CAS: 253870-02-9) is a heterocyclic organic compound containing a pyrrole ring substituted with a formyl group at position 5, methyl groups at positions 2 and 4, and a carboxylic acid group at position 3. It is known for its chemical reactivity and is commonly used in organic synthesis. The molecular formula of this compound is C9H11NO3.

What are the main uses of 5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (CAS: 253870-02-9)?

5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (CAS: 253870-02-9) is primarily used in pharmaceutical research as a building block for drug development. It also finds applications in organic synthesis, material science, and as an intermediate in the production of various chemical compounds. Its unique structure makes it valuable in the creation of bioactive molecules and functional materials.

Is 5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (CAS: 253870-02-9) safe?

5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (CAS: 253870-02-9) is generally considered safe when handled properly. However, it may cause skin and eye irritation, so protective measures such as gloves and goggles are recommended. Safety standards suggest avoiding prolonged exposure and ensuring proper ventilation during use.

How should 5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (CAS: 253870-02-9) be stored?

5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (CAS: 253870-02-9) should be stored in a cool, dry, and well-ventilated area, away from light. It is advisable to keep it in a sealed container to prevent moisture absorption. Proper storage ensures stability and maintains its chemical integrity over time.