(3S)-Tetrahydro-3-furancarboxylic acid

Basic Information

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CAS Number

168395-26-4

Molecular Formula

C5H8O3

Molecular Weight

116.12 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Boiling Point

252.1°Cat760mmHg

Density

1.262

Flash Point

113.2°C

Refractive Index

1.48

SMILES

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C1COCC1C(=O)O

InChI

InChI=1S/C5H8O3/c6-5(7)4-1-2-8-3-4/h4H,1-3H2,(H,6,7)/t4-/m0/s1

InChIKey

BOTREHHXSQGWTR-BYPYZUCNSA-N

LogP

0.10750000000000015

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

99.8

Synonyms & References

English

(3S)-oxolane-3-carboxylic acid
AM20090011
(S)-TETRAHYDRO-3-FURANCARBOXYLIC ACID
(S)-Tetrahydro-furan-3-carboxylic acid
EN300-170463
MFCD07369984
AS-38463
(3S)-3-oxolanecarboxylic acid
TS-01600
DTXSID50654552
A26850
AKOS015855925
3-FURANCARBOXYLIC ACID, TETRAHYDRO-, (3S)-
L-TETRAHYDROFURAN-3-CARBOXYLIC ACID
(S)-Tetrahydrofuran-3-carboxylic acid
SCHEMBL228856
CS-0053249
BOTREHHXSQGWTR-BYPYZUCNSA-N
A810969
168395-26-4
(S)-Tetrahydro-3-furancarboxylic acid
(S)-Tetrahydro-3-furoic acid
(S)-Tetrahydrofuran-3-car...
(3S)-tetrahydro-3-furancarboxylic acid
(3S)-Tetrahydrofuran-3-carboxylic acid
3-Furancarboxylic acid,tetrahydro-, (3S)-
(S)-tetrahydrofuran-3-carboxylic acid(WX900125)
AMOT0066
RP08519
PB26265
BC677393

MDL Number

MFCD07369984

Customs Code

2932190090

FAQ

What are the physical and chemical properties of (3S)-Tetrahydro-3-furancarboxylic acid (CAS: 168395-26-4)?

(3S)-Tetrahydro-3-furancarboxylic acid is a colorless to white crystalline solid with a molecular weight of approximately 132.11 g/mol. It has a pKa value of around 4.7, indicating it is a weak acid. The compound is slightly soluble in water and more soluble in organic solvents such as ethanol and acetone. It is reactive towards bases and can undergo esterification and other acid-base reactions.

How is (3S)-Tetrahydro-3-furancarboxylic acid (CAS: 168395-26-4) typically synthesized?

(3S)-Tetrahydro-3-furancarboxylic acid can be synthesized through the reduction of 3-furancarboxaldehyde with a suitable reducing agent such as sodium borohydride or lithium aluminum hydride. The reaction is typically carried out in an inert solvent like ethanol or diethyl ether. The yield is usually good, and the reaction can be optimized for selectivity and purity.

What industries use (3S)-Tetrahydro-3-furancarboxylic acid (CAS: 168395-26-4)?

(3S)-Tetrahydro-3-furancarboxylic acid is used in various industries, including pharmaceuticals for the synthesis of certain drugs, and as a precursor in the production of polymers and organic semiconductors. It also finds applications in the development of sensors and as a chiral building block in asymmetric synthesis.

What precautions should be taken when handling (3S)-Tetrahydro-3-furancarboxylic acid (CAS: 168395-26-4)?

When handling (3S)-Tetrahydro-3-furancarboxylic acid, use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood to avoid inhalation. Spills should be cleaned up using appropriate absorbents, and the area should be well-ventilated. Always consult the Material Safety Data Sheet (MSDS) for detailed safety information and emergency procedures.