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Home > Indoles and Oxindole > 89645-39-6
89645-39-6 | 2-Propenoic acid, 2-cyano-3-(2-methoxy-3-indolizinyl)-, ethyl ester
CAS No: 89645-39-6 Catalog No: AG003VW0 MDL No:
Product Description
Catalog Number:
AG003VW0
Chemical Name:
2-Propenoic acid, 2-cyano-3-(2-methoxy-3-indolizinyl)-, ethyl ester
CAS Number:
89645-39-6
Molecular Formula:
C15H14N2O3
Molecular Weight:
270.2833
IUPAC Name:
ethyl 2-cyano-3-(2-methoxyindolizin-3-yl)prop-2-enoate
InChI:
InChI=1S/C15H14N2O3/c1-3-20-15(18)11(10-16)8-13-14(19-2)9-12-6-4-5-7-17(12)13/h4-9H,3H2,1-2H3
InChI Key:
IXDMRFCJQGAKTH-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=Cc1c(OC)cc2n1cccc2)C#N
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.1g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.288g/mol
Monoisotopic Mass:
270.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
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