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Home Carboxys Ethyl 3-amino-4-cyano-5-(methylthio)thiophene-2-carboxylate

Ethyl 3-amino-4-cyano-5-(methylthio)thiophene-2-carboxylate

CAS No.:
116170-90-2
Catalog Number:
AG000BSV
Molecular Formula:
C9H10N2O2S2
Molecular Weight:
242.3179
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$38
- +
1g
95%
In Stock USA
United States
$76
- +
5g
95%
In Stock USA
United States
$227
- +
10g
95%
In Stock USA
United States
$409
- +
Product Description
Catalog Number:
AG000BSV
Chemical Name:
Ethyl 3-amino-4-cyano-5-(methylthio)thiophene-2-carboxylate
CAS Number:
116170-90-2
Molecular Formula:
C9H10N2O2S2
Molecular Weight:
242.3179
MDL Number:
MFCD00085050
IUPAC Name:
ethyl 3-amino-4-cyano-5-methylsulfanylthiophene-2-carboxylate
InChI:
InChI=1S/C9H10N2O2S2/c1-3-13-8(12)7-6(11)5(4-10)9(14-2)15-7/h3,11H2,1-2H3
InChI Key:
BMYKQPLSSCCDQS-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1sc(c(c1N)C#N)SC
Properties
Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.018g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
242.311g/mol
Monoisotopic Mass:
242.018g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties