Methyl 3-amino-4-phenyl-2-thiophenecarboxylate

Basic Information

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CAS Number

82437-64-7

Molecular Formula

C12H11NO2S

Molecular Weight

233.29 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

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

69 ºC

Boiling Point

381.6°C at 760 mmHg

Density

1.265

Flash Point

381.6 °C at 760 mmHg

Refractive Index

1.625

SMILES

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COC(=O)C1=C(C(=CS1)C2=CC=CC=C2)N

InChI

InChI=1S/C12H11NO2S/c1-15-12(14)11-10(13)9(7-16-11)8-5-3-2-4-6-8/h2-7H,13H2,1H3

InChIKey

UKWKMKNACSKDCN-UHFFFAOYSA-N

LogP

2.783900000000001

Topological Polar Surface Area

52.32 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

253

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

EN300-211151
F6548-0422
methyl 3-amino-4-phenylthiophene-2-carboxylate
MFCD00206450
3-Amino-4-phenyl-2-thiophenecarboxylic acid methyl ester
SB66984
A864412
DTXSID10374906
METHYL3-AMINO-4-PHENYLTHIOPHENE-2-CARBOXYLATE
Z1741962460
Methyl 3-amino-4-phenylthiophene-2-carboxylate, AldrichCPR
SCHEMBL1883906
3-amino-2-methoxycarbonyl-4-phenylthiophene
FT-0742363
FS-1447
82437-64-7
UKWKMKNACSKDCN-UHFFFAOYSA-N
AKOS005726350
Methyl 3-amino-4-phenylthiophene-2-carboxylate
methyl 3-amino-4-phenyl-2-thiophenecarboxylate
methyl 4-phenyl-3-amino-2-thiophenecarboxylate
AK101634
STL125469
BBL004458
2746AC
SBB098105
VT20191
TRA0127230
AX8233173
AB0097857
H2952

MDL Number

MFCD00206450

Customs Code

2934999090

FAQ

What regulatory guidelines apply to Methyl 3-amino-4-phenyl-2-thiophenecarboxylate (CAS: 82437-64-7)?

Methyl 3-amino-4-phenyl-2-thiophenecarboxylate (CAS: 82437-64-7) should comply with the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for hazardous chemicals. In the European Union, it falls under the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) regulations. The U.S. Food and Drug Administration (FDA) and Environmental Protection Agency (EPA) may also have specific requirements for its use and handling.

Are there alternatives to Methyl 3-amino-4-phenyl-2-thiophenecarboxylate (CAS: 82437-64-7) in synthesis?

Alternative reagents for synthesizing similar compounds include methyl 3-amino-4-phenylthiophene-2-carboxylate or methyl 3-amino-4-(2-thienyl)benzoate. These alternatives can vary in reactivity and may offer different synthetic pathways depending on the desired product.

What is the market or research trend for Methyl 3-amino-4-phenyl-2-thiophenecarboxylate (CAS: 82437-64-7)?

The market trend for Methyl 3-amino-4-phenyl-2-thiophenecarboxylate (CAS: 82437-64-7) is driven by its use in pharmaceutical and fine chemical applications. Research is focusing on its potential as an intermediate in drug discovery and development, with growing interest in its biological activities and synthetic versatility.

How should waste containing Methyl 3-amino-4-phenyl-2-thiophenecarboxylate (CAS: 82437-64-7) be handled?

Waste containing Methyl 3-amino-4-phenyl-2-thiophenecarboxylate (CAS: 82437-64-7) should be collected in appropriate containers and stored in a well-ventilated area. Incineration or professional waste disposal services are recommended for safe disposal. Environmental protection precautions include proper labeling and adherence to local waste management regulations to prevent environmental contamination.