tert-butyl (3R)-3-hydroxybutanoate

Basic Information

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CAS Number

110171-06-7

Molecular Formula

C8H16O3

Molecular Weight

160.21 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 Physical Properties

Melting Point

50-54 °C

SMILES

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CCC(C(=O)OC(C)(C)C)O

InChI

InChI=1S/C8H16O3/c1-6(9)5-7(10)11-8(2,3)4/h6,9H,5H2,1-4H3/t6-/m1/s1

InChIKey

PKPVFILAHLKSNJ-ZCFIWIBFSA-N

LogP

1.099

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

135

Synonyms & References

English

MFCD00210055
CS-0112423
tert-Butyl (R)-2-hydroxybutyrate
(R)-tert-Butyl 2-hydroxybutanoate
AKOS015893991
tert-Butyl(R)-3-hydroxybutanoate
tert-Butyl (R)-2-hydroxybutyrate, 98%
206996-51-2
tert-Butyl (R)-2-hydroxybutyrate, purum, >=98.0% (sum of enantiomers, GC)
C73921
TERT-BUTYL-(R)-(+)-2-HYDROXYBUTYRATE
SCHEMBL473139
TERT-BUTYL (2R)-2-HYDROXYBUTANOATE
110171-06-7
(R)-tert-Butyl2-hydroxybutanoate
J-013533
TERT-BUTYL (R)-2-HYDROXYBUTANOATE
Butanoic acid, 2-hydroxy-, 1,1-dimethylethyl ester, (2R)-
Tert-butyl(R)-2-hydroxybutyrate
DS-16712
TERT-BUTYL (R)-(+)-2-HYDROXYBUTYRATE
Butanoic acid,3-hydroxy-, 1,1-dimethylethyl ester, (3R)-
TERT-BUTYL (R)-2-HYDROXYBUTYRATE
(3R)-3-hydroxybutanoic acid
(3R)-3-hydroxybutyric acid
(R)-(-)-3-HYDROXYBUTYRIC ACID
(R)-3-hydroxybutanoic acid
(R)-3-hydroxybutanoic acid tert-butyl ester
(R)-3-Hydroxybutyrate
D(-)-3-Hydroxybutyrate
D-3-Hydroxybutyric acid

MDL Number

MFCD31718616

Customs Code

2918199090

FAQ

What is tert-butyl (3R)-3-hydroxybutanoate (CAS: 110171-06-7)?

tert-butyl (3R)-3-hydroxybutanoate, also known as tert-butyl 3-hydroxybutyrate, is an organic compound with the molecular formula C7H14O3. It is a colorless liquid with a characteristic odor. It is optically active with a specific rotation of [specific rotation if available].

What are the main uses of tert-butyl (3R)-3-hydroxybutanoate (CAS: 110171-06-7)?

tert-butyl (3R)-3-hydroxybutanoate is primarily used in the pharmaceutical industry as a chiral building block for the synthesis of pharmaceutical compounds. It is also used in the chemical industry for the production of other esters and in research as a chiral auxiliary.

Is tert-butyl (3R)-3-hydroxybutanoate (CAS: 110171-06-7) safe?

tert-butyl (3R)-3-hydroxybutanoate is generally considered safe for use in the laboratory with standard safety precautions. However, it should be handled with care due to its flammability and potential for skin and eye irritation. Proper ventilation and protective equipment are recommended.

How should tert-butyl (3R)-3-hydroxybutanoate (CAS: 110171-06-7) be stored?

tert-butyl (3R)-3-hydroxybutanoate should be stored in a cool, dark place at room temperature to avoid exposure to light and heat, which can cause degradation. It should be kept in a tightly sealed container to prevent evaporation and contamination. Avoid storage in high humidity environments.