Home Carboxys methyl 5-amino-3-(propan-2-yl)thiophene-2-carboxylate

methyl 5-amino-3-(propan-2-yl)thiophene-2-carboxylate

CAS No.:
2091962-29-5
Catalog Number:
AG01DW73
Molecular Formula:
C9H13NO2S
Molecular Weight:
199.2700
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DW73
Chemical Name:
methyl 5-amino-3-(propan-2-yl)thiophene-2-carboxylate
CAS Number:
2091962-29-5
Molecular Formula:
C9H13NO2S
Molecular Weight:
199.2700
MDL Number:
MFCD31667117
IUPAC Name:
methyl 5-amino-3-propan-2-ylthiophene-2-carboxylate
InChI:
InChI=1S/C9H13NO2S/c1-5(2)6-4-7(10)13-8(6)9(11)12-3/h4-5H,10H2,1-3H3
InChI Key:
HPSSHKMHDQMJSP-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc(cc1C(C)C)N
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.067g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.268g/mol
Monoisotopic Mass:
199.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties