6-Nitro-2-benzofuran-1(3H)-one

Basic Information

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CAS Number

610-93-5

Molecular Formula

C8H5NO4

Molecular Weight

179.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

143.0 to 147.0 deg-C

Boiling Point

413.4°C at 760 mmHg

Density

1.519±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

229.6°C

Refractive Index

1.5160 (estimate)

SMILES

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C1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O1

InChI

InChI=1S/C8H5NO4/c10-8-7-3-6(9(11)12)2-1-5(7)4-13-8/h1-3H,4H2

InChIKey

RNWGZXAHUPFXLL-UHFFFAOYSA-N

LogP

1.78840

Complexity

247

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

SMR001547692
J-800291
InChI=1/C8H5NO4/c10-8-7-3-6(9(11)12)2-1-5(7)4-13-8/h1-3H,4H
6-Nitro-2-benzofuran-1(3H)-one
DTXSID00870684
UNII-35QB7T32YC
4Et2OHbicycloNo2,6diene4carboxylate
6-nitro-1,3-dihydro-2-benzofuran-1-one
SR-01000390720
AS-5160
HMS3078N11
6-Nitroisobenzofuran-1(3H)-one
6-Nitrophthalide
SCHEMBL1684401
SR-01000390720-2
Maybridge1_005101
EU-0066960
6-Nitrophthalide, 95%
EN300-108287
AKOS000278155
MLS002638203
Phthalide, 6-nitro-
AM20060448
610-93-5
6-nitro-3H-2-benzofuran-1-one
N1055
NSC11332
SR-01000390720-1
CS-W017285
6-nitroisobenzofuran-1-(3H)-one
35QB7T32YC

MDL Number

MFCD00033529

Customs Code

2932209090

FAQ

What regulatory guidelines apply to 6-Nitro-2-benzofuran-1(3H)-one (CAS: 610-93-5)?

The compound 6-Nitro-2-benzofuran-1(3H)-one (CAS: 610-93-5) is subject to various regulatory guidelines including the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations for EU-based companies, and FDA/EPA requirements for pharmaceutical and agricultural applications. Companies must comply with these regulations for product handling, storage, and disposal.

Are there alternatives to 6-Nitro-2-benzofuran-1(3H)-one in synthesis (CAS: 610-93-5)?

Several alternatives can be used in the synthesis of 6-Nitro-2-benzofuran-1(3H)-one (CAS: 610-93-5), such as using different starting materials like 2-benzofuranones or employing different functional groups for nitration. Common substitutes include 2-nitrobenzofuran and 4-nitrobenzofuran, which can offer similar properties and functionalities.

What is the market or research trend for 6-Nitro-2-benzofuran-1(3H)-one (CAS: 610-93-5)?

The market for 6-Nitro-2-benzofuran-1(3H)-one (CAS: 610-93-5) is driven by its applications in pharmaceuticals, agrochemicals, and organic synthesis. Recent research trends focus on developing its use in novel drug candidates, pesticides, and as an intermediate in the synthesis of other compounds. The demand is expected to grow due to its unique chemical properties and potential in various industries.

How should waste containing 6-Nitro-2-benzofuran-1(3H)-one (CAS: 610-93-5) be handled?

Waste containing 6-Nitro-2-benzofuran-1(3H)-one (CAS: 610-93-5) should be collected and stored in appropriate containers labeled with its contents. Proper incineration or professional waste disposal services should be used to handle this waste. Environmental protection measures, such as neutralizing the waste before disposal, should also be taken to prevent environmental contamination. Compliance with local and international regulations is essential.