2-(Carboxymethyl)-5-oxotetrahydro-2-furancarboxylic acid

Basic Information

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CAS Number

91912-46-8

Molecular Formula

C7H8O6

Molecular Weight

188.14 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

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

431.1°C at 760 mmHg

Density

1.464

Flash Point

183.7°C

Refractive Index

1.495

SMILES

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C1CC(OC1=O)(CC(=O)O)C(=O)O

InChI

InChI=1S/C7H8O6/c8-4(9)3-7(6(11)12)2-1-5(10)13-7/h1-3H2,(H,8,9)(H,11,12)

InChIKey

FMWCVXXCFOTHGM-UHFFFAOYSA-N

LogP

-0.3784999999999999

Topological Polar Surface Area

100.90000000000002 Å²

Hydrogen Bond Donor/Acceptor

2 / 6

Complexity

270

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

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

Synonyms & References

English

SCHEMBL13589960
91912-46-8
A922766
C77146
MFCD00057274
FT-0690478
2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid
DS-9022
AKOS006274359
CS-0161574
2-(CARBOXYMETHYL)-5-OXOOXOLANE-2-CARBOXYLIC ACID
Homocitric acid-gamma-lactone
2-Furanacetic acid,2-carboxytetrahydro-5-oxo-
carboxy 2-(5-oxooxolan-2-yl)acetate
HOMOCITRIC ACID-GAMMA-LACTONE
HOMOCITRIC ACID-G-LACTONE
(+/-)-Homocitric acid lactone
(S)-homocitric acid lactone
2-carboxymethyl-5-oxo-tetrahydro-furan-2-carboxylic acid
Homocitrate lactone
Homocitronensaeurelacton
FCH838702
AK165556
2-Carboxy-5-oxotetrahydrofuran-2-acetic acid

MDL Number

MFCD00057274

FAQ

What is 2-(Carboxymethyl)-5-oxotetrahydro-2-furancarboxylic acid (CAS: 91912-46-8)?

2-(Carboxymethyl)-5-oxotetrahydro-2-furancarboxylic acid is a chemical compound with the CAS number 91912-46-8. It is a colorless or white crystalline solid with a pungent odor. This compound has a molecular formula of C6H6O5 and a molecular weight of 146.12 g/mol.

What are the main uses of 2-(Carboxymethyl)-5-oxotetrahydro-2-furancarboxylic acid (CAS: 91912-46-8)?

2-(Carboxymethyl)-5-oxotetrahydro-2-furancarboxylic acid is primarily used in pharmaceuticals as a precursor for the synthesis of various medicinal compounds. It is also utilized in the food industry as a flavoring agent and in research for studying biodegradation processes.

Is 2-(Carboxymethyl)-5-oxotetrahydro-2-furancarboxylic acid (CAS: 91912-46-8) safe?

2-(Carboxymethyl)-5-oxotetrahydro-2-furancarboxylic acid is generally considered safe for its intended uses. However, it should be handled with caution due to potential skin irritation. Protective gloves and goggles are recommended during handling. Ingestion or inhalation should be avoided, and the compound should be stored in a well-ventilated area.

How should 2-(Carboxymethyl)-5-oxotetrahydro-2-furancarboxylic acid (CAS: 91912-46-8) be stored?

2-(Carboxymethyl)-5-oxotetrahydro-2-furancarboxylic acid should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. The temperature should be maintained below 25°C, and the relative humidity should be controlled to avoid condensation.