6-Nitro-1,3-benzothiazole

Basic Information

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CAS Number

2942-06-5

Molecular Formula

C7H4N2O2S

Molecular Weight

180.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

175-178 °C

Boiling Point

333.7°C at 760 mmHg

Density

1.525

Flash Point

155.6 °C

Refractive Index

1.729

SMILES

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C1=CC2=C(C=C1[N+](=O)[O-])SC=N2

InChI

InChI=1S/C7H4N2O2S/c10-9(11)5-1-2-6-7(3-5)12-4-8-6/h1-4H

InChIKey

QLUFBCVWKTWKBF-UHFFFAOYSA-N

LogP

2.72770

Complexity

194

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

Synonyms & References

English

W-106990
AM84900
VC88LFV9C3
EINECS 220-933-9
6-Nitrobenzothiazole
6-Nitro-1,3-benzothiazole #
6-nitrobenzo[d]thiazole
UNII-VC88LFV9C3
NSC-170646
SY046567
FT-0621271
SCHEMBL393608
MFCD00014569
NSC170646
6-Nitrobenzothiazole, 99%
CS-W004502
2942-06-5
NSC 170646
Benzothiazole, 6-nitro-
STR02426
InChI=1/C7H4N2O2S/c10-9(11)5-1-2-6-7(3-5)12-4-8-6/h1-4
DTXSID10183636
6-Nitro-1,3-benzothiazole
AKOS003288490
NS00048518
A5490
6-nitro-benzothiazole
6-nitrobenzothiazol
Benzothiazole,6-nitro
QLUFBCVWKTWKBF-UHFFFAOYSA-N
PubChem21845

MDL Number

MFCD00014569

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 6-Nitro-1,3-benzothiazole (CAS: 2942-06-5)?

6-Nitro-1,3-benzothiazole (CAS: 2942-06-5) should comply with various regulatory guidelines, including GHS classification for hazardous substances, REACH regulations for European market, and FDA/EPA requirements for safety and environmental impact. Proper storage, handling, and disposal must adhere to these guidelines to ensure safety and regulatory compliance.

Are there alternatives to 6-Nitro-1,3-benzothiazole (CAS: 2942-06-5) in synthesis?

Alternatives to 6-Nitro-1,3-benzothiazole (CAS: 2942-06-5) in synthesis include other nitrogen-containing heterocycles like 2-nitrobenzimidazole and 4-nitrothiadiazole. These compounds offer similar properties and can serve as suitable substitutes depending on the specific application and synthesis requirements.

What is the market or research trend for 6-Nitro-1,3-benzothiazole (CAS: 2942-06-5)?

The market for 6-Nitro-1,3-benzothiazole (CAS: 2942-06-5) is steadily growing, driven by its applications in pharmaceuticals and dyes. Research trends focus on exploring its potential in antiviral and anticancer drug development. Price trends suggest stability, but fluctuations may occur due to supply and demand dynamics in the market.

How should waste containing 6-Nitro-1,3-benzothiazole (CAS: 2942-06-5) be handled?

Waste containing 6-Nitro-1,3-benzothiazole (CAS: 2942-06-5) should be collected in appropriate containers and stored separately. Incineration is a common disposal method, but professional waste disposal services should be utilized to ensure safety and compliance with environmental regulations. Precautions include wearing protective gear and following all safety protocols during handling and disposal.