4-Isopropyl-1,3-benzenediol

Basic Information

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CAS Number

23504-03-2

Molecular Formula

C9H12O2

Molecular Weight

152.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

278.1°C at 760 mmHg

SMILES

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

InChI

InChI=1S/C9H12O2/c1-6(2)8-4-3-7(10)5-9(8)11/h3-6,10-11H,1-2H3

InChIKey

LNFVQIGQENWZQN-UHFFFAOYSA-N

LogP

2.221200000000001

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

123

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

23504-03-2
CS-0154304
4-isopropyl-1,3-benzenediol
4-propan-2-ylbenzene-1,3-diol
MFCD05663778
AMY23274
4-Isopropylresorcinol
4-isopropyl-benzene-1,3-diol
FT-0689860
SY059257
DS-16241
4-isopropylbenzene-1,3-diol
EINECS 245-703-5
1,3-Benzenediol, 4-(1-methylethyl)-
LNFVQIGQENWZQN-UHFFFAOYSA-N
AKOS006292972
4-(1-methylethyl)-1,3-Benzenediol
DTXSID40178070
4-(propan-2-yl)benzene-1,3-diol
EN300-188622
SCHEMBL383417
AC-23024
J-515606
BB 0261930
4-Isopropylbenzene-1,3-diol
2,4-dihydroxy-1-isopropylbenzene
4-(1-methylethyl)-1,3-benzenediol
4-Isopropyl-resorcin
1580AB
AS07039
1,3-Benzenediol,4-

MDL Number

MFCD05663778

Customs Code

2907299090

FAQ

What regulatory guidelines apply to 4-Isopropyl-1,3-benzenediol (CAS: 23504-03-2)?

4-Isopropyl-1,3-benzenediol (CAS: 23504-03-2) falls under several regulatory guidelines including GHS classification, which categorizes it as a flammable liquid. It must comply with REACH regulations in the EU, ensuring that all chemicals and mixtures on the market are safe. FDA and EPA may also have specific requirements for its use in certain applications, particularly in the food and pharmaceutical industries.

Are there alternatives to 4-Isopropyl-1,3-benzenediol (CAS: 23504-03-2) in synthesis?

Several alternatives can be used in the synthesis of 4-Isopropyl-1,3-benzenediol (CAS: 23504-03-2). Common substitutes include 4-tert-butyl-1,3-benzenediol and 4-sec-butyl-1,3-benzenediol. These compounds can serve similar functional roles in various reactions and are often more readily available or have different reactivity profiles.

What is the market or research trend for 4-Isopropyl-1,3-benzenediol (CAS: 23504-03-2)?

The market for 4-Isopropyl-1,3-benzenediol (CAS: 23504-03-2) is growing due to its use in pharmaceuticals, cosmetics, and as a precursor in organic synthesis. Research trends include exploring its applications in green chemistry and developing more sustainable synthesis methods. The demand is also influenced by price trends and regulatory changes in the industry.

How should waste containing 4-Isopropyl-1,3-benzenediol (CAS: 23504-03-2) be handled?

Waste containing 4-Isopropyl-1,3-benzenediol (CAS: 23504-03-2) should be collected in appropriate containers and stored in a well-ventilated area away from heat sources. Incineration is a common method for disposal, but professional waste management services should be used to ensure safety. Environmental protection measures include monitoring for hazardous emissions and adhering to local waste disposal regulations.