Home Carboxys methyl 2-amino-5-cyclohexylthiophene-3-carboxylate

methyl 2-amino-5-cyclohexylthiophene-3-carboxylate

CAS No.:
1350623-54-9
Catalog Number:
AG01BHH7
Molecular Formula:
C12H17NO2S
Molecular Weight:
239.3339
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Product Description
Catalog Number:
AG01BHH7
Chemical Name:
methyl 2-amino-5-cyclohexylthiophene-3-carboxylate
CAS Number:
1350623-54-9
Molecular Formula:
C12H17NO2S
Molecular Weight:
239.3339
MDL Number:
MFCD08059075
IUPAC Name:
methyl 2-amino-5-cyclohexylthiophene-3-carboxylate
InChI:
InChI=1S/C12H17NO2S/c1-15-12(14)9-7-10(16-11(9)13)8-5-3-2-4-6-8/h7-8H,2-6,13H2,1H3
InChI Key:
SVUCTYASPQFMPN-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(sc1N)C1CCCCC1
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.098g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.333g/mol
Monoisotopic Mass:
239.098g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties