Name: Name:4H-Pyran-3-carboxylicacid, 6-amino-5-cyano-4-(2-furanyl)-2-methyl-, ethyl ester
Brand: Angene
SKU: AG005R3N
Rating: 90 (10 reviews)

4H-Pyran-3-carboxylicacid, 6-amino-5-cyano-4-(2-furanyl)-2-methyl-, ethyl ester

CAS No.:

72568-56-0

Catalog Number:

AG005R3N

Molecular Formula:

C14H14N2O4

Molecular Weight:

274.2720

Catalog Number:

AG005R3N

Chemical Name:

4H-Pyran-3-carboxylicacid, 6-amino-5-cyano-4-(2-furanyl)-2-methyl-, ethyl ester

CAS Number:

72568-56-0

Molecular Formula:

C14H14N2O4

Molecular Weight:

274.2720

MDL Number:

MFCD00422178

IUPAC Name:

ethyl 6-amino-5-cyano-4-(furan-2-yl)-2-methyl-4H-pyran-3-carboxylate

InChI:

InChI=1S/C14H14N2O4/c1-3-18-14(17)11-8(2)20-13(16)9(7-15)12(11)10-5-4-6-19-10/h4-6,12H,3,16H2,1-2H3

InChI Key:

ONXZBQSHSGQIFU-UHFFFAOYSA-N

SMILES:

CCOC(=O)C1=C(C)OC(=C(C1c1ccco1)C#N)N

Complexity:

527

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

274.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

274.276g/mol

Monoisotopic Mass:

274.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

98.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6