Methyl 3-((tert-butoxycarbonyl)amino)thiophene-2-carboxylate

Base Information

• Chemical Name: Methyl 3-((tert-butoxycarbonyl)amino)thiophene-2-carboxylate
• CAS No.: 149587-72-4
• Molecular Formula: C₁₁H₁₅NO₄S
• Molecular Weight: 257.31
• Hs Code.: 2934999090
• European Community (EC) Number: 694-504-3
• DSSTox Substance ID: DTXSID40596538
• Wikidata: Q82491821
• Mol file: 149587-72-4.mol

Synonyms:149587-72-4;Methyl 3-((tert-butoxycarbonyl)amino)thiophene-2-carboxylate;methyl 3-[(tert-butoxycarbonyl)amino]thiophene-2-carboxylate;3-tert-Butoxycarbonylamino-thiophene-2-carboxylic acid methyl ester;methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylate;MFCD01763684;2-thiophenecarboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester;3-tert-ButoxycarbonylaMino-thiophene-2-carboxylicacidMethylester;3-tert-Butoxycarbonylaminothiophene-2-carboxylic acid methyl ester;methyl 3-{[(tert-butoxy)carbonyl]amino}thiophene-2-carboxylate;Methyl 3-(Boc-amino)thiophene-2-carboxylate;JEMOHNKXRFEUDT-UHFFFAOYSA-N;Oprea1_080955;SCHEMBL2106155;DTXSID40596538;STL090030;AKOS005173799;AS-73898;SY123650;DB-357272;CS-0037157;Methyl 3-(Boc-amino)-thiophene-2-carboxylate;VU0549345-1;EN300-255909;F30969;Methyl 3-(Boc-amino)thiophene-2-carboxylate, 97%;methyl 3-t-butoxycarbonylaminothiophene-2-carboxylate;F9995-0346;Methyl 3-(t-butoxycarbonylamino)thiophene-2-carboxylate;methyl 3-(tert-butoxycarbonylamino)thiophene-2-carboxylate

Chemical Property of Methyl 3-((tert-butoxycarbonyl)amino)thiophene-2-carboxylate

Chemical Property:

• Melting Point: 88-93°C
• Boiling Point: 321.2±27.0 °C(Predicted)
• PKA: 13.09±0.70(Predicted)
• PSA: 92.87000
• Density: 1.250±0.06 g/cm3(Predicted)
• LogP: 2.95470
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 257.07217913
• Heavy Atom Count: 17
• Complexity: 300

Purity/Quality:

97% ^*data from raw suppliers

3-tert-Butoxycarbonylamino-thiophene-2-carboxylicAcidMethylEster ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 43
• Safety Statements: 36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC1=C(SC=C1)C(=O)OC

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