Methyl 3-amino-2-thiophenecarboxylate - ≥99% , CAS No.22288-78-4

CAS: 22288-78-4 Cat. No.: M102354 Molecular Weight: 157.19 EC Number: 244-895-8

GRADE & PURITY ≥99%

Synonyms

3-amino-thiophene-2-carboxylicacid methylester | 3-anino-2-carbomethoxythiophene | 3-Amino-2-carbomethoxythiophene | AM82004 | SCHEMBL102285 | EINECS 244-895-8 | Ethyl 3-(4-nitrophenyl)acrylate | FT-0602360 | methyl 3-aminothiophen-2-carboxylate | AC-6762

Storage

Argon charged,Room temperature

Shipped In

Normal

Overview

Methyl 3-amino-2-thiophenecarboxylate reacts with hydrazonoyl chlorides in the presence of triethylamine to yield corresponding N-arylamidrazones.
Methyl 3-amino-2-thiophenecarboxylate was used in: the synthesis of 4-nitro and 4-aminothienyl ureas total synthesis of quinazolinocarboline alkaloids preparation of thienopyrimidinone analogs

Specifications

Synonyms

3-amino-thiophene-2-carboxylicacid methylester | 3-anino-2-carbomethoxythiophene | 3-Amino-2-carbomethoxythiophene | AM82004 | SCHEMBL102285 | EINECS 244-895-8 | Ethyl 3-(4-nitrophenyl)acrylate | FT-0602360 | methyl 3-aminothiophen-2-carboxylate | AC-6762

Specifications & Purity

≥99%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥99%

Names and Identifiers

• Pubchem Sid: 488186560
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186560
• Canonical Smiles: COC(=O)C1=C(C=CS1)N
• IUPAC Name: methyl 3-aminothiophene-2-carboxylate
• InChIKey: TWEQNZZOOFKOER-UHFFFAOYSA-N
• INCHI: 1S/C6H7NO2S/c1-9-6(8)5-4(7)2-3-10-5/h2-3H,7H2,1H3
• Isomeric SMILES: COC(=O)C1=C(C=CS1)N
• WGK Germany: 3
• RTECS: XM8347500
• Molecular Weight: 157.19
• Reaxy-Rn: 1365614
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1365614&ln=

Chemical and Physical Properties

• Sensitivity: Light sensitive
• Boil Point(°C): 100-102°C
• Melt Point(°C): 62-64°C
• Molecular Weight: 157.190 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 157.02 Da
• Monoisotopic Mass: 157.02 Da
• Topological Polar Surface Area: 80.600 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 140.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1