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Home > Indoles and Oxindole > 137476-59-6
137476-59-6 | 1H-Indol-5-ol, 3-(1-azabicyclo[2.2.2]oct-3-yl)-
CAS No: 137476-59-6 Catalog No: AG0013C0 MDL No:
Product Description
Catalog Number:
AG0013C0
Chemical Name:
1H-Indol-5-ol, 3-(1-azabicyclo[2.2.2]oct-3-yl)-
CAS Number:
137476-59-6
Molecular Formula:
C15H18N2O
Molecular Weight:
242.3162
IUPAC Name:
3-(1-azabicyclo[2.2.2]octan-3-yl)-1H-indol-5-ol
InChI:
InChI=1S/C15H18N2O/c18-11-1-2-15-12(7-11)13(8-16-15)14-9-17-5-3-10(14)4-6-17/h1-2,7-8,10,14,16,18H,3-6,9H2
InChI Key:
RVCMYAWBNRTLIC-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)c(c[nH]2)C1CN2CCC1CC2
Properties
Complexity:
314
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:
2
Isotope Atom Count:
0
Molecular Weight:
242.322g/mol
Monoisotopic Mass:
242.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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