3,5-Bis(2-methyl-2-propanyl)-1,2-benzenediol

Basic Information

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CAS Number

1020-31-1

Molecular Formula

C14H22O2

Molecular Weight

222.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

99.0 to 102.0 deg-C

Boiling Point

145°C/5mmHg

Water Solubility

Insoluble in water.

Flash Point

136.5℃

Refractive Index

1.4576 (estimate)

SMILES

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

InChI

InChI=1S/C14H22O2/c1-13(2,3)9-7-10(14(4,5)6)12(16)11(15)8-9/h7-8,15-16H,1-6H3

InChIKey

PJZLSMMERMMQBJ-UHFFFAOYSA-N

LogP

3.6928000000000027

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

234

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

Stability

Stable. Combustible. Incompatible with strong oxidizing agents.

Synonyms & References

English

DTXSID4061414
SCHEMBL247483
MFCD00008819
3,5-di-tert-butylbenzene-1,2-diol
3,5-Ditert-butyl-catechol
Z1192367739
3,5-Di-tert-butyl-1,2-dihydroxybenzene
1,2-Benzenediol,3,5-bis(1,1-dimethylethyl)-,labeled with oxygen-18(9ci)
NSC 59767
InChI=1/C14H22O2/c1-13(2,3)9-7-10(14(4,5)6)12(16)11(15)8-9/h7-8,15-16H,1-6H
Oprea1_834691
1020-31-1
CHEMBL1795400
3,5-ditert-butylbenzene-1,2-diol
3,5-Di-t-butylcatechol
D2432
NS00023102
3,5-Di-tert-butyl-1,2-benzenediol
PS-7820
3,5-ditertiarybutylcatechol
CCRIS 5827
3,5-Di-tert-butylcatechol, 98%
Pyrocatechol,5-di-tert-butyl-
1, 3,5-di(1,1-dimethylethyl)-
EN300-77174
CS-0154919
Q27251465
AKOS015837934
Pyrocatechol, 3,5-di-tert-butyl-
DI-TERT-BUTYLCATECHOL, 3,5-
3,5-bis(tert-butyl)benzene-1,2-diol

MDL Number

MFCD00008819

Customs Code

29072900

FAQ

What is 3,5-Bis(2-methyl-2-propanyl)-1,2-benzenediol (CAS: 1020-31-1)?

3,5-Bis(2-methyl-2-propanyl)-1,2-benzenediol is a chemical compound with the CAS number 1020-31-1. It is a colorless solid with a pungent odor. This compound is characterized by its molecular formula C12H20O2 and exhibits properties such as solubility in organic solvents and low volatility.

What are the main uses of 3,5-Bis(2-methyl-2-propanyl)-1,2-benzenediol (CAS: 1020-31-1)?

3,5-Bis(2-methyl-2-propanyl)-1,2-benzenediol is primarily used in the synthesis of other organic compounds and in the production of fragrances. It can also be found in certain pharmaceutical formulations and as a reagent in laboratory research.

Is 3,5-Bis(2-methyl-2-propanyl)-1,2-benzenediol (CAS: 1020-31-1) safe?

3,5-Bis(2-methyl-2-propanyl)-1,2-benzenediol is generally considered safe for most applications, provided that appropriate safety precautions are followed. It is important to handle the compound in a well-ventilated area and wear proper personal protective equipment. Ingestion, inhalation, or skin contact should be avoided.

How should 3,5-Bis(2-methyl-2-propanyl)-1,2-benzenediol (CAS: 1020-31-1) be stored?

3,5-Bis(2-methyl-2-propanyl)-1,2-benzenediol should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to keep the compound in tightly sealed containers to maintain its stability. Avoid storing it near incompatible materials.