Methyl 3-amino-4-cyano-5-(dimethylamino)thiophene-2-carboxylate

Base Information

• Chemical Name: Methyl 3-amino-4-cyano-5-(dimethylamino)thiophene-2-carboxylate
• CAS No.: 175202-32-1
• Molecular Formula: C9H11 N3 O2 S
• Molecular Weight: 225.26800
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID20381085
• Wikidata: Q82171702
• Mol file: 175202-32-1.mol

Synonyms:175202-32-1;methyl 3-amino-4-cyano-5-(dimethylamino)thiophene-2-carboxylate;2-Thiophenecarboxylic acid, 3-amino-4-cyano-5-(dimethylamino)-, methyl ester;DTXSID20381085;YJNFNKKEZQZWAL-UHFFFAOYSA-N;MFCD00085111;2-Thiophenecarboxylicacid, 3-amino-4-cyano-5-(dimethylamino)-, methylester;AKOS015908823;FT-0628532;7D-036;A811839;Methyl 3-amino-4-cyano-5-(dimethylamino)thiophene-2carboxylate

Chemical Property of Methyl 3-amino-4-cyano-5-(dimethylamino)thiophene-2-carboxylate

Chemical Property:

• Vapor Pressure: 3.88E-08mmHg at 25°C
• Melting Point: 240oC
• Boiling Point: 445.6oC at 760 mmHg
• Flash Point: 223.3oC
• PSA: 107.59000
• Density: 1.33g/cm3
• LogP: 1.63578
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 225.05719778
• Heavy Atom Count: 15
• Complexity: 299

Purity/Quality:

98%min ^*data from raw suppliers

METHYL 3-AMINO-4-CYANO-5-(DIMETHYLAMINO)THIOPHENE-2-CARBOXYLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn:Harmful
• Statements: R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
• Safety Statements: S36/37:Wear suitable protective clothing and gloves.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=C(C(=C(S1)C(=O)OC)N)C#N