1,3-adamantanedimethanol

Basic Information

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CAS Number

17071-62-4

Molecular Formula

C12H20O2

Molecular Weight

196.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Flash Point

158.5℃

SMILES

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OCC1(CC2CC3C1)CC(CO)(C2)C3

InChI

InChI=1S/C12H20O2/c13-7-11-2-9-1-10(4-11)5-12(3-9,6-11)8-14/h9-10,13-14H,1-8H2

InChIKey

RABVYVVNRHVXPJ-UHFFFAOYSA-N

LogP

1.5575999999999999

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Synonyms & References

English

Adamantane-1,3-diyldimethanol
1,3-Adamantanediol
1,3-Dihydroxyadamantane
1,3-ADAMANTANDIOL
ADAMANTANE-1,3-DIOL
AKOS BC-0470
TRICYCLO[3.3.1.13,7]DECANE-1,3-DIOL
1,3-Admantane-dimethanol
1,3-ADMANTANE
1,3-ADAMANTANEDIMETHANOL
1,3-adamantane-dimethanol
1,3-bis(2-hydroxymethyl)adamantane
1,3-bis(hydroxymethyl)-5-fluorouracil
1,3-Bis(hydroxymethyl)adamantan
1,3-bis(hydroxymethyl)adamantane
1,3-bis-hydroxymethyl-
1,3-Bis-hydroxymethyl-adamantan
1,3-dihydroxymethyl-5-fluorouracil
1,3-dimethylol-5-fluorouracil
2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1,3-bis(hydroxymethyl)-
bis(hydroxymethyl)-5-fluorouracil
CTK2H0486
SureCN1953767
1,3-Adamantanedimethanol(6CI,8CI)
1,3-Dihydroxymethyladamantane
[3-(hydroxymethyl)-1-adamantyl]methanol
[3-(hydroxymethyl)adamantan-1-yl]methanol
1,3-bis(2-hydro

MDL Number

MFCD00154014

FAQ

What are the physical and chemical properties of 1,3-adamantanedimethanol (CAS: 17071-62-4)?

1,3-Adamantanedimethanol (CAS: 17071-62-4) is a colorless, crystalline solid with a molecular weight of approximately 228.3 g/mol. It is slightly soluble in water but soluble in common organic solvents like ethanol and acetone. The compound is known for its low reactivity and good thermal stability. It can form hydrogen bonds due to its hydroxyl groups, which influences its solubility and interaction with other molecules.

How is 1,3-adamantanedimethanol (CAS: 17071-62-4) typically synthesized?

1,3-Adamantanedimethanol (CAS: 17071-62-4) is synthesized through the reduction of 1,3-adamantanedione using zinc and hydrochloric acid as a catalyst. The reduction process is highly selective and yields a high percentage of the desired product. Alternative methods include the use of other reducing agents like sodium borohydride under controlled conditions.

What industries use 1,3-adamantanedimethanol (CAS: 17071-62-4)?

1,3-Adamantanedimethanol (CAS: 17071-62-4) is primarily used in the pharmaceutical industry for the synthesis of drugs. It is also utilized in the production of high-performance polymers and as a precursor in the development of sensors and semiconductors. Its unique properties, such as thermal stability and solubility, make it suitable for these diverse applications.

What precautions should be taken when handling 1,3-adamantanedimethanol (CAS: 17071-62-4)?

When handling 1,3-adamantanedimethanol (CAS: 17071-62-4), it is important to use appropriate personal protective equipment (PPE) such as gloves, safety glasses, and a lab coat. Work should be conducted in a well-ventilated area or under a fume hood to minimize inhalation exposure. In case of spill, neutralize the spill with an appropriate cleaning agent and dispose of the waste according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.