Home Other Building Blocks ETHYL 3-AMINO-6-CYANOBENZOFURAN-2-CARBOXYLATE

ETHYL 3-AMINO-6-CYANOBENZOFURAN-2-CARBOXYLATE

CAS No.:
1782594-34-6
Catalog Number:
AG01DKEX
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
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Product Description
Catalog Number:
AG01DKEX
Chemical Name:
ETHYL 3-AMINO-6-CYANOBENZOFURAN-2-CARBOXYLATE
CAS Number:
1782594-34-6
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
IUPAC Name:
ethyl 3-amino-6-cyano-1-benzofuran-2-carboxylate
InChI:
InChI=1S/C12H10N2O3/c1-2-16-12(15)11-10(14)8-4-3-7(6-13)5-9(8)17-11/h3-5H,2,14H2,1H3
InChI Key:
JDCTYFVPOYYOAG-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1oc2c(c1N)ccc(c2)C#N
Properties
Complexity:
349  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.069g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.223g/mol
Monoisotopic Mass:
230.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
89.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties