O-2-Naphthyl methyl(3-methylphenyl)carbamothioate

Basic Information

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CAS Number

2398-96-1

Molecular Formula

C19H17NOS

Molecular Weight

307.42 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

111.0 to 115.0 deg-C

Boiling Point

453.4°C at 760 mmHg

Water Solubility

<0.1 g/100 mL at 22 ºC

Flash Point

228 °C

Solubility

Soluble in chloroform at 50 mg/ml. Sparingly soluble in ethanol or methanol

Refractive Index

1.6970 (estimate)

SMILES

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CN(C(=S)Oc1ccc2ccccc2c1)c3cccc(C)c3

InChI

InChI=1S/C19H17NOS/c1-14-6-5-9-17(12-14)20(2)19(22)21-18-11-10-15-7-3-4-8-16(15)13-18/h3-13H,1-2H3

InChIKey

FUSNMLFNXJSCDI-UHFFFAOYSA-N

LogP

4.948320000000003

Topological Polar Surface Area

12.47 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

386

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

Toxicity

LD50 in mice, rats (g/kg): >10, >6 orally; >6, >4 s.c. (Hashimoto)

Synonyms & References

English

tolnaftate
O-2-naphthyl N,3-dimethyl(thiocarbanilate)
TOLAFTATE
O-Naphthalen-2-yl N-methyl-N-(3-methylphenyl)thiocarbamate
O-2-Naphthyl methyl(3-methylphenyl)thiocarbamate
TOLNAFRATE
Aftate
Dermoxin
Focusan
Methyl-(3-methylphenyl)carbamothioic acid O-2-naphthyl ester
Methyl(3-methylphenyl)carbamothioic Acid O-2-Naphthyl Ester
O-2-Naphthyl Methyl(3-methylphenyl)carbamothioate
Pitrex
sorgoa
Timoped
Tinactin
Tinavet
Tritin
2-Naphthyl N-methyl-N-(3-tolyl)thionocarbamate
NP-27
Tolnaftate

MDL Number

MFCD00056611

Customs Code

2930909090

FAQ

What is O-2-Naphthyl methyl(3-methylphenyl)carbamothioate (CAS: 2398-96-1)?

O-2-Naphthyl methyl(3-methylphenyl)carbamothioate (CAS: 2398-96-1) is a chemical compound that belongs to the class of carbamothioates. It is characterized by its structure, which includes a naphthyl group, a methyl group, and a 3-methylphenyl group connected through a carbamothioate linkage. This compound is known for its potential applications in organic synthesis and pharmaceutical research due to its versatile functional groups.

What are the main uses of O-2-Naphthyl methyl(3-methylphenyl)carbamothioate (CAS: 2398-96-1)?

O-2-Naphthyl methyl(3-methylphenyl)carbamothioate (CAS: 2398-96-1) is primarily used in pharmaceutical research as an intermediate for drug development. It also finds applications in organic synthesis for creating complex molecules. Additionally, it may be used in industrial processes involving functional group modifications and in research for studying chemical reactivity and biological activity.

Is O-2-Naphthyl methyl(3-methylphenyl)carbamothioate (CAS: 2398-96-1) safe?

O-2-Naphthyl methyl(3-methylphenyl)carbmothioate (CAS: 2398-96-1) should be handled with care. It may have potential toxicity, especially through inhalation or skin contact. Proper safety measures, such as wearing gloves, goggles, and a lab coat, are recommended. It is important to follow safety standards and consult safety data sheets for appropriate handling and disposal procedures.

How should O-2-Naphthyl methyl(3-methylphenyl)carbamothioate (CAS: 2398-96-1) be stored?

O-2-Naphthyl methyl(3-methylphenyl)carbamothioate (CAS: 2398-96-1) should be stored in a cool, dry, and dark place to maintain its stability. It is best kept in a sealed container away from moisture and air exposure. Storage at temperatures below 25°C is recommended, and it should be protected from light to prevent degradation. Always store in a well-ventilated area and follow standard chemical storage guidelines.