1,3-Cyclohexanedicarboxylic acid

Basic Information

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CAS Number

3971-31-1

Molecular Formula

C8H12O4

Molecular Weight

172.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Physical Properties

Melting Point

149°C

Boiling Point

332.4°C at 760 mmHg

Density

1.314

Flash Point

169°C

Refractive Index

1.521

SMILES

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C1CC(CC(C1)C(=O)O)C(=O)O

InChI

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

InChIKey

XBZSBBLNHFMTEB-UHFFFAOYSA-N

LogP

0.962

Topological Polar Surface Area

74.6 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

179

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

DTXSID70883923
AB86177
cyclohexane-1,3-dicarboxylicacid
A824702
SY042634
C2186
SCHEMBL35888
8DAS52OH65
PB47963
PB40932
NCGC00330334-01
PB48231
Z443356938
AB01325024-02
AKOS016843625
MFCD00134411
CS-W022620
MFCD20760249
FT-0689760
ZB1691
AKOS003271009
UNII-8DAS52OH65
3971-31-1
DS-5478
SY042614
FT-0689761
1,3-Cyclohexanedicarboxylic acid
cis-1,3-cyclohexanedicarboxylicacid
1,3-cyclohexanedicarboxylic
1,3-cyclohexane dicarboxylic acid
FT-0635085

MDL Number

MFCD00134411

Customs Code

2917209090

FAQ

What is 1,3-Cyclohexanedicarboxylic acid (CAS: 3971-31-1)?

1,3-Cyclohexanedicarboxylic acid is a colorless, crystalline solid with the CAS number 3971-31-1. It is a dicarboxylic acid with a cyclohexane ring structure, which gives it unique chemical properties. This compound is used in various applications such as pharmaceuticals, resins, and coatings due to its stability and reactivity.

What are the main uses of 1,3-Cyclohexanedicarboxylic acid (CAS: 3971-31-1)?

1,3-Cyclohexanedicarboxylic acid is widely used in the pharmaceutical industry for the synthesis of polymers and resins, as well as in the production of coatings and adhesives. It is also utilized in textile and paper industries for improving the properties of these materials. Additionally, it is employed in research and development due to its versatile chemical properties.

Is 1,3-Cyclohexanedicarboxylic acid (CAS: 3971-31-1) safe?

1,3-Cyclohexanedicarboxylic acid is generally considered safe for industrial use when proper handling and safety precautions are followed. However, it is important to wear protective clothing, gloves, and eye protection when working with this compound to avoid skin contact and inhalation of dust. Ensure proper ventilation during use.

How should 1,3-Cyclohexanedicarboxylic acid (CAS: 3971-31-1) be stored?

1,3-Cyclohexanedicarboxylic acid should be stored in a cool, dry place away from direct sunlight and heat sources. It is best kept in a sealed container to prevent moisture absorption. Maintain a temperature below 25°C to ensure stability. Avoid exposure to strong acids and bases as they can cause degradation. Store in a well-ventilated area to prevent the buildup of flammable gases.