(1R,2R)-1,2-Cyclohexanedicarboxylic acid

Basic Information

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CAS Number

46022-05-3

Molecular Formula

C8H12O4

Molecular Weight

172.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Physical Properties

Melting Point

180.0 to 185.0 deg-C

Boiling Point

384.075°C at 760 mmHg

Density

1.315

Flash Point

200.254 °C

Solubility

Soluble in acetone.

Refractive Index

-18 ° (C=1, Acetone)

SMILES

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OC(=O)[C@@H]1CCCC[C@H]1C(=O)O

InChI

InChI=1S/C8H12O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)/t5-,6-/m1/s1

InChIKey

QSAWQNUELGIYBC-PHDIDXHHSA-N

LogP

0.962

Topological Polar Surface Area

74.6 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

177

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

(1R,2R)-Cyclohexane-1,2-dicarboxylic acid
(R,R)-CYCLOHEXANE-1,2-DICARBOXYLIC ACID
(1R,2R)-(?-trans-Cyclohexane-1,2-dicarboxylic acid
(1R 2R)-(-)-TRANS-CYCLOHEXANE-1 2-DICAR&
(1R,2R)-(-)-1,2-CYCLOHEXANEDICARBOXYLIC ACID
(1R,2R)-(-)-trans-cyclohexane-1,2-dicar-boxylic acid
(1R,2R)-1,2-Cyclohexanedicarboxylic Acid
(1R,2R)-Trans 1,2-cyclohexane dicarboxylic acid
(R,R)-1,2-Cyclohexanedicarboxylic Acid
1,2-Cyclohexanedicarboxylicacid, (1R,2R)-
endo-1R,2R Lurasidone Isomer I
endo-1R,2S Lurasidone Isomer VII
endo-1S,2R Lurasidone Isomer V
endo-1S,2S Lurasidone Isomer III
exo-1R,2S Lurasidone Isomer VI
exo-1S,2R Lurasidone Isomer IV
exo-1S,2S Lurasidone Isomer II
Lurasidone Intermediate II
trans-1,2-Cyclohexanedicarboxylic acid
(1R,2R)-(-)-trans-cyclohexane-1,2-dicarboxylic acid
(1R,2R)-cyclohexane-1,2-dicarboxylic acid

MDL Number

MFCD00062973

Customs Code

29171900

FAQ

What is (1R,2R)-1,2-Cyclohexanedicarboxylic acid (CAS: 46022-05-3)?

(1R,2R)-1,2-Cyclohexanedicarboxylic acid (CAS: 46022-05-3) is a chiral dicarboxylic acid with the chemical formula C6H10O4. It features two carboxylic acid groups attached to a cyclohexane ring and exhibits specific stereochemistry at the 1 and 2 positions. This compound is known for its stability and is commonly used in organic synthesis due to its versatile functional groups.

What are the main uses of (1R,2R)-1,2-Cyclohexanedicarboxylic acid (CAS: 46022-05-3)?

(1R,2R)-1,2-Cyclohexanedicarboxylic acid (CAS: 46022-05-3) is widely utilized in pharmaceuticals as a precursor for drug synthesis, in industrial applications for polymer production, and in research for creating complex organic molecules. It also serves as a key component in the development of coatings, resins, and specialty chemicals due to its reactivity and structural properties.

Is (1R,2R)-1,2-Cyclohexanedicarboxylic acid (CAS: 46022-05-3) safe?

Safety of (1R,2R)-1,2-Cyclohexanedicarboxylic acid (CAS: 46022-05-3) depends on handling conditions. While it is not classified as highly toxic, direct contact may cause skin or eye irritation. Proper protective equipment, such as gloves and goggles, is recommended during use. Always follow safety standards outlined in chemical safety data sheets (SDS) for safe handling and disposal.

How should (1R,2R)-1,2-Cyclohexanedicarboxylic acid (CAS: 46022-05-3) be stored?

(1R,2R)-1,2-Cyclohexanedicarboxylic acid (CAS: 46022-05-3) should be stored in a cool, dry place away from light. It is stable at room temperature but should be kept in a sealed, airtight container to prevent moisture absorption. Avoid exposure to strong oxidizing agents to maintain its chemical integrity and ensure long-term storage safety.