Methyl 3-amino-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylate

Base Information

• Chemical Name: Methyl 3-amino-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylate
• CAS No.: 691393-99-4
• Molecular Formula: C14H13NO2S
• Molecular Weight: 259.32
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID90373356
• Wikidata: Q82161514
• Mol file: 691393-99-4.mol

Synonyms:691393-99-4;methyl 3-amino-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylate;3-AMINO-4,5-DIHYDRONAPHTHO[1,2-B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER;methyl 3-amino-4,5-dihydrobenzo[g][1]benzothiole-2-carboxylate;DTXSID90373356;AKOS005146313;D-fructose1,6-bis(dihydrogenphosphate);FT-0644849;A847208;methyl3-amino-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylate

Chemical Property of Methyl 3-amino-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylate

Chemical Property:

• Vapor Pressure: 3.25E-09mmHg at 25°C
• Refractive Index: 1.666
• Boiling Point: 475.7°C at 760 mmHg
• PKA: 2.07±0.20(Predicted)
• Flash Point: 241.5°C
• PSA: 80.56000
• Density: 1.324g/cm³
• LogP: 3.46370
• Storage Temp.: 2-8°C
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 259.06669983
• Heavy Atom Count: 18
• Complexity: 336

Purity/Quality:

98% ^*data from raw suppliers

Methyl3-amino-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=C(C2=C(S1)C3=CC=CC=C3CC2)N