Methyl 4-carbamimidoylbenzoate hydrochloride (1:1)

Basic Information

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CAS Number

42823-73-4

Molecular Formula

C9H11ClN2O2

Molecular Weight

214.65 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 Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

White to Yellow Solid

SMILES

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Cl.COC(=O)c1ccc(cc1)C(=N)N

InChI

InChI=1S/C9H10N2O2.ClH/c1-13-9(12)7-4-2-6(3-5-7)8(10)11;/h2-5H,1H3,(H3,10,11);1H

InChIKey

SANDFJWTZYOLPM-UHFFFAOYSA-N

LogP

1.17907

Topological Polar Surface Area

76.17 Å²

Hydrogen Bond Donor/Acceptor

3 / 4

Complexity

208

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

Methyl 4-carbamimidoylbenzoate hydrochloride
Benzoic acid, 4-(aminoiminomethyl)-, methyl ester, monohydrochloride
4-amidinobenzoic acid methyl ester hydrochloride
4-Carbamimidoyl-benzoesaeure-methylester,Hydrochlorid
4-carbamimidoyl-benzoic acid methyl ester,hydrochloride
4-METHOXYCARBONYL-BENZAMIDINE HYDROCHLORIDE
methyl 4-carbamimidoylbenzoate
METHYL 4-CARBAMIMIDOYLBENZOATE HCL
methyl p-amidinobenzoate hydrochloride
p-methoxycarbonylbenzamidine hydrochloride
SANDFJWTZYOLPM-UHFFFAOYSA-N
4-Methoxycarbonyl-benzamidine, HCl
7067AJ
4-carbomethoxybenzamidine hydrochloride
AB60963
SY028770
Methyl4-CarbamimidoylbenzoateHydrochloride
methyl 4-carbamimidoylbenzoate;hy

MDL Number

MFCD10697977

FAQ

What is Methyl 4-carbamimidoylbenzoate hydrochloride (CAS: 42823-73-4)?

Methyl 4-carbamimidoylbenzoate hydrochloride (CAS: 42823-73-4) is a chemical compound used in pharmaceutical and industrial applications. Its molecular formula is C10H11N3O2•HCl. This compound has a bitter taste and is soluble in water and ethanol.

What are the main uses of Methyl 4-carbamimidoylbenzoate hydrochloride (CAS: 42823-73-4)?

Methyl 4-carbamimidoylbenzoate hydrochloride (CAS: 42823-73-4) is primarily used in the pharmaceutical industry as an intermediate in the synthesis of other compounds. It is also used in the formulation of certain medications and in research for its pharmacological properties.

Is Methyl 4-carbamimidoylbenzoate hydrochloride (CAS: 42823-73-4) safe?

Methyl 4-carbamimidoylbenzoate hydrochloride (CAS: 42823-73-4) is generally considered safe when handled with proper protective measures. However, it should be used in a well-ventilated area and avoid contact with eyes and skin. Ingestion or inhalation can be hazardous.

How should Methyl 4-carbamimidoylbenzoate hydrochloride (CAS: 42823-73-4) be stored?

Methyl 4-carbamimidoylbenzoate hydrochloride (CAS: 42823-73-4) should be stored in a cool, dry place away from heat and direct sunlight. It should be kept in a tightly sealed container to prevent moisture absorption. The storage temperature should be below 25°C to ensure stability.