6-Methoxy-1,3-benzothiazole-2-carboxylic acid

Basic Information

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CAS Number

946-13-4

Molecular Formula

C9H7NO3S

Molecular Weight

209.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

119-120 ºC

Boiling Point

412 ºC

Density

1.465

Flash Point

203 ºC

SMILES

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COC1=CC2=C(C=C1)N=C(S2)C(=O)O

InChI

InChI=1S/C9H7NO3S/c1-13-5-2-3-6-7(4-5)14-8(10-6)9(11)12/h2-4H,1H3,(H,11,12)

InChIKey

JDKMYJZEGZZJOH-UHFFFAOYSA-N

LogP

2.0031

Topological Polar Surface Area

59.42 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

236

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

Benzothiazole-2-carboxylic acid, 6-methoxy-
CS-0067221
6-Methoxy-1,3-benzothiazole-2-carboxylic acid #
Oprea1_667520
AKOS000678718
J-518856
6-methoxybenzo[d]thiazole-2-carboxylic acid
6-Methoxy-1,3-benzothiazole-2-carboxylic acid
A845023
2-Benzothiazolecarboxylicacid, 6-methoxy-
2-Benzothiazolecarboxylic acid, 6-methoxy-
6-Methoxybenzo[d]thiazole-2-carboxylicacid
JDKMYJZEGZZJOH-UHFFFAOYSA-N
6-Methoxy-benzothiazole-2-carboxylic acid
AMY16270
6-methoxybenzothiazole-2-carboxylic acid
Oprea1_034387
AS-19981
EN300-255858
6-methoxybenzothiazole-2-carboxylic acid, AldrichCPR
TimTec1_007174
SCHEMBL3634489
CBDivE_000842
JBZ
946-13-4
FT-0687583
MFCD01119043
DTXSID50344421
CBDivE_007587
6-Methoxybenzo[d]thiazole-2-carboxylic acid
RARECHEM AL BO 0241

MDL Number

MFCD01119043

FAQ

What is 6-Methoxy-1,3-benzothiazole-2-carboxylic acid (CAS: 946-13-4)?

6-Methoxy-1,3-benzothiazole-2-carboxylic acid (CAS: 946-13-4) is a chemical compound that belongs to the class of benzothiazole derivatives. It features a benzene ring with a 2-carboxylic acid group and a methoxy group. This compound is known for its potential use in pharmaceutical applications and as an intermediate in various chemical syntheses.

What are the main uses of 6-Methoxy-1,3-benzothiazole-2-carboxylic acid (CAS: 946-13-4)?

The main uses of 6-Methoxy-1,3-benzothiazole-2-carboxylic acid (CAS: 946-13-4) include its role as a key intermediate in the synthesis of other compounds, particularly in the pharmaceutical industry. It is also used in the preparation of dyes and pigments due to its chemical properties.

Is 6-Methoxy-1,3-benzothiazole-2-carboxylic acid (CAS: 946-13-4) safe?

6-Methoxy-1,3-benzothiazole-2-carboxylic acid (CAS: 946-13-4) is generally considered safe under proper handling conditions. However, it is important to follow all recommended safety precautions and use appropriate personal protective equipment (PPE) to avoid exposure. Direct contact with the eyes, skin, or inhalation should be avoided.

How should 6-Methoxy-1,3-benzothiazole-2-carboxylic acid (CAS: 946-13-4) be stored?

6-Methoxy-1,3-benzothiazole-2-carboxylic acid (CAS: 946-13-4) should be stored in a cool, dry place, away from direct sunlight and heat sources. It is recommended to keep it in a tightly sealed container to prevent moisture absorption. The storage temperature should not exceed 25°C, and containers should be checked regularly for any signs of deterioration or leakage.