Home Aminos methyl 2-amino-5-(thiophen-2-yl)benzoate

methyl 2-amino-5-(thiophen-2-yl)benzoate

CAS No.:
926254-39-9
Catalog Number:
AG019NCT
Molecular Formula:
C12H11NO2S
Molecular Weight:
233.2862
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Product Description
Catalog Number:
AG019NCT
Chemical Name:
methyl 2-amino-5-(thiophen-2-yl)benzoate
CAS Number:
926254-39-9
Molecular Formula:
C12H11NO2S
Molecular Weight:
233.2862
MDL Number:
MFCD09042420
IUPAC Name:
methyl 2-amino-5-thiophen-2-ylbenzoate
InChI:
InChI=1S/C12H11NO2S/c1-15-12(14)9-7-8(4-5-10(9)13)11-3-2-6-16-11/h2-7H,13H2,1H3
InChI Key:
PNNRKISKHNTAHL-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(ccc1N)c1cccs1
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.285g/mol
Monoisotopic Mass:
233.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties