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106637-45-0 | 1-Propanone, 1-[7-ethyl-3-(2-hydroxyethyl)-1H-indol-2-yl]-
CAS No: 106637-45-0 Catalog No: AG007ULK MDL No:
Product Description
Catalog Number:
AG007ULK
Chemical Name:
1-Propanone, 1-[7-ethyl-3-(2-hydroxyethyl)-1H-indol-2-yl]-
CAS Number:
106637-45-0
Molecular Formula:
C15H19NO2
Molecular Weight:
245.3169
IUPAC Name:
1-[7-ethyl-3-(2-hydroxyethyl)-1H-indol-2-yl]propan-1-one
InChI:
InChI=1S/C15H19NO2/c1-3-10-6-5-7-11-12(8-9-17)15(13(18)4-2)16-14(10)11/h5-7,16-17H,3-4,8-9H2,1-2H3
InChI Key:
CVZQGAZLFXLYEQ-UHFFFAOYSA-N
SMILES:
OCCc1c([nH]c2c1cccc2CC)C(=O)CC
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
245.322g/mol
Monoisotopic Mass:
245.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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