4,5-Difluoro-1-indanone

Basic Information

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CAS Number

628732-11-6

Molecular Formula

C9H6F2O

Molecular Weight

168.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Boiling Point

259.7°C at 760 mmHg

SMILES

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C1CC(=O)C2=C1C(=C(C=C2)F)F

InChI

InChI=1S/C9H6F2O/c10-7-3-1-5-6(9(7)11)2-4-8(5)12/h1,3H,2,4H2

InChIKey

FHKJIIXGCLYMCN-UHFFFAOYSA-N

LogP

2.0937

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

205

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

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

Synonyms & References

English

AKOS012979870
EN300-7355166
DTXSID30446351
4,5-DIFLUORO-1-INDANONE
FHKJIIXGCLYMCN-UHFFFAOYSA-N
MFCD07772124
4 pound not5-Difluoro-2 pound not3-dihydro-1H-inden-1-one
628732-11-6
SY047083
CS-W009081
AC-2273
AB42240
4,5-Difluoro-2,3-dihydro-1H-inden-1-one
4,5-difluoro-2,3-dihydroinden-1-one
1H-INDEN-1-ONE, 4,5-DIFLUORO-2,3-DIHYDRO-
Z1147191117
A834058
4,5-Difluoro-indan-1-one
4,5-Difluoroindan-1-one
SCHEMBL1339423
FT-0646408
A26844
AM9393
AS-16172
4,5-bis(fluoranyl)-2,3-dihydroinden-1-one
1H-Inden-1-one,4,5-difluoro-2,3-dihydro-
4,5-DIFLUOROINDAN-1-ONE
AMOT0796
S968
ST2417895
AB0000809

MDL Number

MFCD07772124

Customs Code

2914700090

FAQ

What regulatory guidelines apply to 4,5-Difluoro-1-indanone (CAS: 628732-11-6)?

4,5-Difluoro-1-indanone (CAS: 628732-11-6) falls under the regulatory guidelines of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) and is subject to the European Union's Registration, Evaluation, Authorization and Restriction of Chemicals (REACH) regulations. It is also regulated by the Food and Drug Administration (FDA) and Environmental Protection Agency (EPA) in the United States, focusing on safety, handling, and environmental impact.

Are there alternatives to 4,5-Difluoro-1-indanone (CAS: 628732-11-6) in synthesis?

In synthesis, 4,5-Difluoro-1-indanone (CAS: 628732-11-6) can be replaced with other indanone derivatives or fluorinated compounds. Common alternatives include 3,4-difluoro-1-indanone and 4-fluoro-1-indanone, which offer similar functional groups for various chemical reactions and can be used as precursors in drug discovery and synthesis of other organic compounds.

What is the market or research trend for 4,5-Difluoro-1-indanone (CAS: 628732-11-6)?

The market for 4,5-Difluoro-1-indanone (CAS: 628732-11-6) is growing due to its potential in medicinal chemistry and pharmaceuticals. Research trends indicate increasing interest in its use as a lead compound in the development of anti-inflammatory and anticancer drugs. Market demand is expected to rise with advancements in molecular profiling and drug screening technologies.

How should waste containing 4,5-Difluoro-1-indanone (CAS: 628732-11-6) be handled?

Waste containing 4,5-Difluoro-1-indanone (CAS: 628732-11-6) should be collected in appropriate containers and handled according to local waste management regulations. Professional waste disposal services are recommended for proper incineration or chemical treatment to ensure environmental safety. Precautions include personal protective equipment (PPE) and adhering to safety protocols to minimize exposure and environmental impact.