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Home > Indoles and Oxindole > 164082-80-8
164082-80-8 | 1H-Indole, 2-ethyl-4-methoxy-1-(phenylmethyl)-
CAS No: 164082-80-8 Catalog No: AG001UMZ MDL No:MFCD09833269
Product Description
Catalog Number:
AG001UMZ
Chemical Name:
1H-Indole, 2-ethyl-4-methoxy-1-(phenylmethyl)-
CAS Number:
164082-80-8
Molecular Formula:
C18H19NO
Molecular Weight:
265.3496
MDL Number:
MFCD09833269
IUPAC Name:
1-benzyl-2-ethyl-4-methoxyindole
InChI:
InChI=1S/C18H19NO/c1-3-15-12-16-17(10-7-11-18(16)20-2)19(15)13-14-8-5-4-6-9-14/h4-12H,3,13H2,1-2H3
InChI Key:
CICJSMPBNORTQN-UHFFFAOYSA-N
SMILES:
CCc1cc2c(n1Cc1ccccc1)cccc2OC
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.147g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.356g/mol
Monoisotopic Mass:
265.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
14.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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