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Home > Indoles and Oxindole > 113801-35-7
113801-35-7 | 1H-Indole, 1-ethyl-3-[2-(4-methoxyphenyl)ethenyl]-
CAS No: 113801-35-7 Catalog No: AG0009PX MDL No:
Product Description
Catalog Number:
AG0009PX
Chemical Name:
1H-Indole, 1-ethyl-3-[2-(4-methoxyphenyl)ethenyl]-
CAS Number:
113801-35-7
Molecular Formula:
C19H19NO
Molecular Weight:
277.3603
IUPAC Name:
1-ethyl-3-[2-(4-methoxyphenyl)ethenyl]indole
InChI:
InChI=1S/C19H19NO/c1-3-20-14-16(18-6-4-5-7-19(18)20)11-8-15-9-12-17(21-2)13-10-15/h4-14H,3H2,1-2H3
InChI Key:
XTYBDKPLPHUZGA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C=Cc1cn(c2c1cccc2)CC
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.147g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.367g/mol
Monoisotopic Mass:
277.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
14.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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