2,2-Dimethyltetrahydro-4H-pyran-4-one

Basic Information

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CAS Number

1194-16-7

Molecular Formula

C7H12O2

Molecular Weight

128.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

178.3°C at 760 mmHg

Water Solubility

Slightly soluble in water.

Flash Point

60-64°C/8mm

SMILES

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CC1(CC(=O)CCO1)C

InChI

InChI=1S/C7H12O2/c1-7(2)5-6(8)3-4-9-7/h3-5H2,1-2H3

InChIKey

BWMNOXJVRHGUQM-UHFFFAOYSA-N

LogP

1.1445

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

127

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

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

2,2-Dimethyl-tetrahydro-pyran-4-one
SY006372
A2479
J-506833
DS-10721
FT-0651420
4H-Pyran-4-one, tetrahydro-2,2-dimethyl-
MFCD01549337
1194-16-7
AKOS004119828
Tetrahydro-2,2-dimethyl-4H-pyran-4-one
EN300-77049
2,2-dimethyloxan-4-one
SB18549
SCHEMBL622572
tetrahydro-2,2-dimethylpyran-4-one
2,2-dimethyltetrahydro-4H-pyran-4-one
AM20080139
DTXSID10365056
2,2-Dimethyldihydro-2H-pyran-4(3H)-one
BWMNOXJVRHGUQM-UHFFFAOYSA-N
2,2-dimethyl-tetrahydropyran-4-one
2,2-Dimethyltetrahydropyran-4-one
Tetrahydro-2,2-dimethyl-4H-pyran-4-one;2,2-Dimethyltetrahydropyran-4-one
CS-D0378
2,2-DIMETHYL-TETRAHYDRO-PYRAN-4-ONE
AKOS NCG-0015
(2,2-dimethyldihydro-2H-pyran-4(3H)-one
2,2-dimethyl-2H-3,5,6-trihydropyran-4-one
PubChem24423
AMOT0063

MDL Number

MFCD01549337

Customs Code

2932999099

FAQ

What is 2,2-Dimethyltetrahydro-4H-pyran-4-one (CAS: 1194-16-7)?

2,2-Dimethyltetrahydro-4H-pyran-4-one (CAS: 1194-16-7) is an organic compound with the molecular formula C7H10O2. It is a cyclic ether that belongs to the family of pyran derivatives. This compound is characterized by its ring structure and is commonly used in pharmaceuticals and organic synthesis due to its structural properties.

What are the main uses of 2,2-Dimethyltetrahydro-4H-pyran-4-one (CAS: 1194-16-7)?

2,2-Dimethyltetrahydro-4H-pyran-4-one (CAS: 1194-16-7) is primarily used in the pharmaceutical industry as a precursor for the synthesis of various medicinal compounds. It is also used in the organic synthesis of dyestuffs and as a building block in the development of new materials.

Is 2,2-Dimethyltetrahydro-4H-pyran-4-one (CAS: 1194-16-7) safe?

2,2-Dimethyltetrahydro-4H-pyran-4-one (CAS: 1194-16-7) is considered safe when handled properly. However, it should be used with caution due to its flammability. Protective measures include wearing appropriate personal protective equipment and ensuring proper ventilation. Ingestion, inhalation, or skin contact should be avoided.

How should 2,2-Dimethyltetrahydro-4H-pyran-4-one (CAS: 1194-16-7) be stored?

2,2-Dimethyltetrahydro-4H-pyran-4-one (CAS: 1194-16-7) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture and light exposure. The storage area should have good ventilation and be accessible only to trained personnel to ensure safety.