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Home > Indoles and Oxindole > 88234-60-0
88234-60-0 | 1H-Indole, 2-(5-ethoxy-3,4-dihydro-2H-pyrrol-3-yl)-1-methyl-
CAS No: 88234-60-0 Catalog No: AG004B47 MDL No:
Product Description
Catalog Number:
AG004B47
Chemical Name:
1H-Indole, 2-(5-ethoxy-3,4-dihydro-2H-pyrrol-3-yl)-1-methyl-
CAS Number:
88234-60-0
Molecular Formula:
C15H18N2O
Molecular Weight:
242.3162
IUPAC Name:
2-(5-ethoxy-3,4-dihydro-2H-pyrrol-3-yl)-1-methylindole
InChI:
InChI=1S/C15H18N2O/c1-3-18-15-9-12(10-16-15)14-8-11-6-4-5-7-13(11)17(14)2/h4-8,12H,3,9-10H2,1-2H3
InChI Key:
DEOOHTPMGMXZPG-UHFFFAOYSA-N
SMILES:
CCOC1=NCC(C1)c1cc2c(n1C)cccc2
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.322g/mol
Monoisotopic Mass:
242.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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