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88234-58-6 | 2H-Pyrrole, 5-ethoxy-3,4-dihydro-3-(7-methoxy-2-benzofuranyl)-
CAS No: 88234-58-6 Catalog No: AG004CXE MDL No:
Product Description
Catalog Number:
AG004CXE
Chemical Name:
2H-Pyrrole, 5-ethoxy-3,4-dihydro-3-(7-methoxy-2-benzofuranyl)-
CAS Number:
88234-58-6
Molecular Formula:
C15H17NO3
Molecular Weight:
259.3004
IUPAC Name:
5-ethoxy-3-(7-methoxy-1-benzofuran-2-yl)-3,4-dihydro-2H-pyrrole
InChI:
InChI=1S/C15H17NO3/c1-3-18-14-8-11(9-16-14)13-7-10-5-4-6-12(17-2)15(10)19-13/h4-7,11H,3,8-9H2,1-2H3
InChI Key:
ZRFMNKVWTFCXDR-UHFFFAOYSA-N
SMILES:
CCOC1=NCC(C1)c1cc2c(o1)c(OC)ccc2
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.121g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.305g/mol
Monoisotopic Mass:
259.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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