Methyl 3-amino-4-methylbenzoate

Basic Information

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CAS Number

18595-18-1

Molecular Formula

C9H11NO2

Molecular Weight

165.19 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

Basic Physical Properties

Melting Point

114.0 to 117.0 deg-C

Boiling Point

296.3℃ at 760 mmHg

Flash Point

152.5℃

SMILES

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CC1=C(C=C(C=C1)C(=O)OC)N

InChI

InChI=1S/C9H11NO2/c1-6-3-4-7(5-8(6)10)9(11)12-2/h3-5H,10H2,1-2H3

InChIKey

YEPWCJHMSVABPQ-UHFFFAOYSA-N

LogP

1.36382

Topological Polar Surface Area

52.32 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

170

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

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

Nilotinib impurity B
Methyl 3-amino-p-toluate
UNII-CUK1YN8P3C
DTXSID90320269
NS00007954
CUK1YN8P3C
A4114
YEPWCJHMSVABPQ-UHFFFAOYSA-N
SB76382
AM20030223
J-011928
SCHEMBL85805
SY003661
3-amino-4-methyl-benzoic acid methyl ester
AC-7315
Methyl 3-amino-4-methylbenzoate, 97%
EN300-18881
J-522139
NSC356832
3-Amino-p-toluic Acid Methyl Ester
18595-18-1
3-amino-4-methyl-benzoic acid, methyl ester
InChI=1/C9H11NO2/c1-6-3-4-7(5-8(6)10)9(11)12-2/h3-5H,10H2,1-2H3
Methyl 4-methyl-3-aminobenzoate
Benzoic acid, 3-amino-4-methyl-, methyl ester
NSC 356832
HY-W010106
MFCD00025206
EC 606-067-8
Nilotinib EP impurity B
TS-02210

MDL Number

MFCD00025206

Customs Code

2922499990

FAQ

What is Methyl 3-amino-4-methylbenzoate (CAS: 18595-18-1)?

Methyl 3-amino-4-methylbenzoate is an organic compound with the chemical formula C10H12N2O2. It is a derivative of benzoic acid, containing an amino group and a methyl group at specific positions. The compound is known for its aromatic structure and is commonly used in various chemical applications. Its CAS number is 18595-18-1.

What are the main uses of Methyl 3-amino-4-methylbenzoate (CAS: 18595-18-1)?

Methyl 3-amino-4-methylbenzoate is primarily used in pharmaceutical research as an intermediate for drug synthesis. It also finds applications in the fragrance and dye industries due to its aromatic properties. Additionally, it may be used in organic chemistry for structural studies and as a reagent in various chemical reactions. Its CAS number is 18595-18-1.

Is Methyl 3-amino-4-methylbenzoate (CAS: 18595-18-1) safe?

Methyl 3-amino-4-methylbenzoate is generally considered safe when handled properly. However, it should be treated with caution, as it may cause skin or eye irritation. Safety standards recommend using appropriate personal protective equipment (PPE) like gloves and goggles. It is important to follow standard chemical safety protocols to ensure safe handling and use. Its CAS number is 18595-18-1.

How should Methyl 3-amino-4-methylbenzoate (CAS: 18595-18-1) be stored?

Methyl 3-amino-4-methylbenzoate should be stored in a cool, dry, and well-ventilated area away from direct sunlight. It is best kept in a sealed container to prevent moisture absorption. The storage temperature should be maintained below 25°C, and it should be protected from heat and humidity to ensure stability. Its CAS number is 18595-18-1.