Home Carboxys methyl 2-amino-5-tert-butylthiophene-3-carboxylate

methyl 2-amino-5-tert-butylthiophene-3-carboxylate

CAS No.:
216574-71-9
Catalog Number:
AG00BHL9
Molecular Formula:
C10H15NO2S
Molecular Weight:
213.2966
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Product Description
Catalog Number:
AG00BHL9
Chemical Name:
methyl 2-amino-5-tert-butylthiophene-3-carboxylate
CAS Number:
216574-71-9
Molecular Formula:
C10H15NO2S
Molecular Weight:
213.2966
MDL Number:
MFCD08059073
IUPAC Name:
methyl 2-amino-5-tert-butylthiophene-3-carboxylate
InChI:
InChI=1S/C10H15NO2S/c1-10(2,3)7-5-6(8(11)14-7)9(12)13-4/h5H,11H2,1-4H3
InChI Key:
FMRKIVIZYXHGAO-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(sc1N)C(C)(C)C
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.295g/mol
Monoisotopic Mass:
213.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties