2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one

Basic Information

View in Editor

CAS Number

101-38-2

Molecular Formula

C6H2Cl3NO

Molecular Weight

210.45 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Physical Properties

Melting Point

64.0 to 67.0 deg-C

Boiling Point

262.3°Cat760mmHg

Flash Point

104.3°C

Refractive Index

1.5470 (estimate)

SMILES

View in Editor

C1=C(C(=O)C(=CC1=NCl)Cl)Cl

InChI

InChI=1S/C6H2Cl3NO/c7-4-1-3(10-9)2-5(8)6(4)11/h1-2H

InChIKey

YHUMTHWQGWPJOQ-UHFFFAOYSA-N

LogP

2.4093

Topological Polar Surface Area

29.43 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

266

Safety Information

View Safety Information

GHS Hazard Pictograms

H242

H315

H319

H335

Hazard Statement

H242 Heating may cause a fire
Self-reactive substances and mixtures; and Organic peroxides

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 5.1 Class 5.1

Stability

Stable. Keep refrigerated.

Sensitiveness

Sensitive to light, prone to moisture absorption

Synonyms & References

English

YHUMTHWQGWPJOQ-UHFFFAOYSA-N
2,6-Dichloroquinone-4-chloroimide
SY048612
CHEMBL3276931
2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one #
3-07-00-03377 (Beilstein Handbook Reference)
N,2,6-Trichloro-p-benzoquinoneimide
D88188
N,6-Trichloro-p-benzoquinonimine
C6H2Cl3NO
N,2,6-Trichloro-p-quinoneimine
101-38-2
GIBBS REAGENT [MI]
N,6-Trichlorobenzoquinone imine
NSC 6293
2,6-dichloro-4-chloroiminocyclohexa-2,5-dien-1-one
NS00023054
2,6-Dichloro-4-N-chloroquinonimine
YHUMTHWQGWPJOQ-UHFFFAOYSA-
2, 2,6-dichloro-4-(chloroimino)-
T0397
4-Chloroimino-2,6-dichloro-2,5-cyclohexadiene-1-one
N,2,6-Trichlorobenzoquinone imine
EINECS 202-937-2
FS-4501
2,6-Dichloroquinone chloroimide
Gibbs' reagent
AI3-52333
N,2,6-Trichloro-p-benzoquinone Monoimine
2, 4-chloroimino-2,6-dichloro-
2,6-Dichloro-1,4-quinone-4-chlorimide

MDL Number

MFCD00001611

FAQ

What regulatory guidelines apply to 2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one (CAS: 101-38-2)?

2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one (CAS: 101-38-2) is subject to various regulatory guidelines including the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the European Union, and FDA/EPA requirements for chemical safety assessments. Specific handling and disposal must comply with local and international regulations to ensure occupational safety and environmental protection.

Are there alternatives to 2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one in synthesis?

There are several alternatives to 2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one in synthesis, including 2,6-dichloropyridine and 4-chloro-2-hydrazinocyclohex-1-ene. These compounds can serve similar roles in chemical reactions, offering researchers and industrial chemists options based on reactivity and safety considerations.

What is the market or research trend for 2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one (CAS: 101-38-2)?

The market for 2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one (CAS: 101-38-2) is driven by its use in the synthesis of other pharmaceuticals and agrochemicals. Recent research trends focus on its applicability in organic synthesis, particularly in the development of new antiviral and antibacterial agents. Market trends indicate a steady demand supported by ongoing pharmaceutical and agricultural innovation.

How should waste containing 2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one (CAS: 101-38-2) be handled?

Waste containing 2,6-Dichloro-4-(chloroimino)-2,5-cyclohexadien-1-one (CAS: 101-38-2) should be collected in appropriate containers, labeled with the content and hazardous nature, and disposed of through professional waste management services. Proper incineration or chemical neutralization methods are recommended to ensure compliance with environmental protection standards and to prevent environmental contamination.