3-Amino-5-(methoxycarbonyl)benzoic acid

Basic Information

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CAS Number

28179-47-7

Molecular Formula

C9H9NO4

Molecular Weight

195.17 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

SMILES

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COC(=O)C1=CC(=CC(=C1)C(=O)O)N

InChI

InChI=1S/C9H9NO4/c1-14-9(13)6-2-5(8(11)12)3-7(10)4-6/h2-4H,10H2,1H3,(H,11,12)

InChIKey

QGGKQIDRZUUHAR-UHFFFAOYSA-N

LogP

0.7536

Topological Polar Surface Area

89.62 Å²

Hydrogen Bond Donor/Acceptor

3 / 5

Complexity

241

Synonyms & References

English

DTXSID20543823
5-aminoisophthalic acid methyl ester
MFCD00224870
AMY13959
3-Amino-5-(methoxycarbonyl)benzoic acid
Monomethyl 5-amino isophthalate
Monomethyl-5-Amino-Isophthalate
28179-47-7
EN300-179245
SY104327
AB04984
3-amino-5-methoxycarbonylbenzoic acid
SCHEMBL2205901
DS-1759
FT-0646801
QGGKQIDRZUUHAR-UHFFFAOYSA-N
A5375
5-Aminoisophthalic acid monomethyl ester
MONOMETHYL 5-AMINOISOPHTHALATE
AC-635
3-Amino-5-(methoxycarbonyl)benzoicacid
AKOS005146116
3-(methoxycarbonyl)-5-aminobenzoic acid
5-Aminoisophthalic acid monomethylester 3-Amino-5-(methoxycarbonyl)benzoic acid
MONO-METHYL 5-AMINOISOPHTHALATE
5-Amino-isophthalic acid monomethyl ester
Methyl 3-amino-5-carboxybenzoate

MDL Number

MFCD00224870

Customs Code

2942000000

FAQ

What is 3-Amino-5-(methoxycarbonyl)benzoic acid (CAS: 28179-47-7)?

3-Amino-5-(methoxycarbonyl)benzoic acid (CAS: 28179-47-7) is a chemical compound with a molecular formula of C9H10NO4. It is a white or off-white solid with a characteristic odor. This compound is soluble in water and has a melting point of about 210-212°C.

What are the main uses of 3-Amino-5-(methoxycarbonyl)benzoic acid (CAS: 28179-47-7)?

3-Amino-5-(methoxycarbonyl)benzoic acid is primarily used in the production of pharmaceuticals, particularly as an intermediate for synthesizing other organic compounds. It also finds applications in the synthesis of various research chemicals and as a reagent in organic chemistry.

Is 3-Amino-5-(methoxycarbonyl)benzoic acid (CAS: 28179-47-7) safe?

3-Amino-5-(methoxycarbonyl)benzoic acid (CAS: 28179-47-7) is generally considered safe under standard laboratory procedures. However, it is important to follow safety guidelines, such as wearing appropriate personal protective equipment (PPE) and handling it in a well-ventilated area. Exposure to the skin or eyes should be avoided, and appropriate first aid measures should be taken if contact occurs.

How should 3-Amino-5-(methoxycarbonyl)benzoic acid (CAS: 28179-47-7) be stored?

3-Amino-5-(methoxycarbonyl)benzoic acid (CAS: 28179-47-7) should be stored in a cool, dry place away from direct sunlight and moisture. It is best kept in a tightly sealed container to prevent degradation. The storage temperature should be below 25°C to maintain its stability.