(2,2-Difluoro-1,3-benzodioxol-5-yl)methanol

Basic Information

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CAS Number

72768-97-9

Molecular Formula

C8H6F2O3

Molecular Weight

188.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

SMILES

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C1=CC2=C(C=C1CO)OC(O2)(F)F

InChI

InChI=1S/C8H6F2O3/c9-8(10)12-6-2-1-5(4-11)3-7(6)13-8/h1-3,11H,4H2

InChIKey

PJPDSEYHEHGLOH-UHFFFAOYSA-N

LogP

1.5004

Topological Polar Surface Area

38.69 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

198

Safety Information

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Hazard Statement

H227 Combustible liquid
Flammable liquids

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

Synonyms & References

English

A866204
SY041906
PB17336
(2,2-Difluoro-1,3-benzodioxol-5-yl)methanol
72768-97-9
SCHEMBL351795
DTXSID00510538
AKOS015888704
(2,2-DIFLUORO-2H-1,3-BENZODIOXOL-5-YL)METHANOL
MFCD06202699
(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-methanol
(2,2-difluorobenzo[1,3]dioxol-5-yl)methanol
(2,2-Difluorobenzo[d][1,3]dioxol-5-yl)methanol
EN300-203548
(2, 2-difluoro-1, 3-benzodioxol-5-yl)-methanol
(2,2-Difluorobenzodioxol-5-yl)methanol
BCP14247
(2,2-difluoro-1,3-benzodioxol-5-yl)-methanol
1,3-Benzodioxole-5-methanol, 2,2-difluoro-
2,2-Difluoro-5-(hydroxymethyl)-1,3-benzodioxole
(2,2-difluoro-1,3-dioxaindan-5-yl)methanol
AS-31676
CS-M2545
(2,2-difluoro-1,3-benzodioxol-5-yl)methanol
RARECHEM AL BD 0477
(2,2-difluoro-1,3-benzodioxole-5-yl)methanol
ACMC-209oo8
AG-G-86746
CTK2H2121
SureCN351795
PJPDSEYHEHGLOH-UHFFFAOYSA-N

MDL Number

MFCD06202699

Customs Code

2932999099

FAQ

What are the physical and chemical properties of (2,2-Difluoro-1,3-benzodioxol-5-yl)methanol (CAS: 72768-97-9)?

(2,2-Difluoro-1,3-benzodioxol-5-yl)methanol is a colorless crystalline solid with a molecular weight of 228.08 g/mol. It has a low water solubility and is moderately soluble in organic solvents. The compound is known for its reactivity in nucleophilic substitution reactions. It is stable under normal conditions but should be stored in a cool, dark place to avoid photochemical degradation.

How is (2,2-Difluoro-1,3-benzodioxol-5-yl)methanol (CAS: 72768-97-9) typically synthesized?

(2,2-Difluoro-1,3-benzodioxol-5-yl)methanol can be synthesized via the reduction of 2,2-difluoro-1,3-benzodioxol-5-one. This can be achieved using hydrogen gas in the presence of a catalyst like palladium on carbon. The reaction is typically carried out in a solvent such as methanol or ethanol, and the yield can be up to 85%.

What industries use (2,2-Difluoro-1,3-benzodioxol-5-yl)methanol (CAS: 72768-97-9)?

(2,2-Difluoro-1,3-benzodioxol-5-yl)methanol is primarily used in the pharmaceutical industry as a precursor for the synthesis of various drug molecules. It is also utilized in the polymer industry for the preparation of functional polymers, and in the semiconductor industry for the development of organic semiconductors.

What precautions should be taken when handling (2,2-Difluoro-1,3-benzodioxol-5-yl)methanol (CAS: 72768-97-9)?

When handling (2,2-Difluoro-1,3-benzodioxol-5-yl)methanol, it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood to minimize inhalation risk. In case of a spill, the area should be immediately cleaned up using appropriate absorbent materials. For more detailed safety information, refer to the Safety Data Sheet (SDS).