3-(1H-Pyrrol-1-yl)propanoic acid

Basic Information

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CAS Number

32807-28-6

Molecular Formula

C7H9NO2

Molecular Weight

139.15 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Melting Point

14-16 ºC

Boiling Point

97°C/11mmHg

Water Solubility

71 g/L (20 ºC)

Refractive Index

n20/D 1.456(lit.)

SMILES

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COC(=O)CC(=O)CCl

InChI

InChI=1S/C7H9NO2/c9-7(10)3-6-8-4-1-2-5-8/h1-2,4-5H,3,6H2,(H,9,10)

InChIKey

RZJWSGHNRLPGHP-UHFFFAOYSA-N

LogP

0.9627999999999999

Topological Polar Surface Area

42.230000000000004 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

121

Safety Information

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Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

methyl 4-chloro-acetoacetate
FT-0618156
AKOS000119618
W-106820
4-chloro-3-oxobutanoic acid methyl ester
4-Chloro-3-oxo-butyric acid methyl ester
Methyl 4-chloro-3-oxobutanoate
methyl 4-chloranyl-3-oxidanylidene-butanoate
ACETOACETIC ACID, 4-CHLORO-, METHYL ESTER
4-chloro aceto acetic acid methyl ester
methyl-gamma-chloroacetoacetate
methyl 4-chloro-3-oxo-butyrate
Methyl .gamma.-chloroacetoacetate
3-03-00-01207 (Beilstein Handbook Reference)
4-chloro-3-oxobutanoic acid, methyl ester
Methyl .omega.-chloroacetoacetate
methyl-4-chloroacetoacetate
Methyl gamma-chloroacetoacetate
UNII-FVC6V863Y2
EN300-19679
NS00029354
4-chloro-3-oxobutanoic acid. methyl ester
STR04472
EINECS 251-230-5
BCP19731
CHEMBL173804
CS-0044248
.gamma.-Chloroacetoacetic acid, methyl ester
Methyl 4-chloro-3-oxobutyrate
32807-28-6
F0001-0971

MDL Number

MFCD00000938

Customs Code

2918300090

FAQ

What is 3-(1H-Pyrrol-1-yl)propanoic acid (CAS: 32807-28-6)?

3-(1H-Pyrrol-1-yl)propanoic acid (CAS: 32807-28-6) is a chemical compound with the molecular formula C6H9NO2. It is an organic acid with a pyrrole ring attached to the side chain of a propionic acid. This compound has a distinct odor and is used in various applications.

What are the main uses of 3-(1H-Pyrrol-1-yl)propanoic acid (CAS: 32807-28-6)?

3-(1H-Pyrrol-1-yl)propanoic acid is primarily used as a reagent in organic synthesis, pharmaceuticals, and as a research compound. It is also utilized in the production of certain chemicals and materials.

Is 3-(1H-Pyrrol-1-yl)propanoic acid (CAS: 32807-28-6) safe?

3-(1H-Pyrrol-1-yl)propanoic acid is generally safe when handled properly. It is not classified as a hazardous material but may cause skin and eye irritation. Protective measures include wearing gloves and goggles. It is important to follow safety guidelines and use appropriate ventilation.

How should 3-(1H-Pyrrol-1-yl)propanoic acid (CAS: 32807-28-6) be stored?

Store 3-(1H-Pyrrol-1-yl)propanoic acid in a closed container away from direct sunlight and heat. Maintain a temperature below 25°C and keep it dry to avoid degradation. Ensure good ventilation during handling and storage to prevent the formation of harmful fumes.