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Home > Indoles and Oxindole > 52351-43-6
52351-43-6 | 1H-Indole, 4,5,6,7-tetrahydro-1-(4-methoxyphenyl)-2-phenyl-
CAS No: 52351-43-6 Catalog No: AG006UMQ MDL No:
Product Description
Catalog Number:
AG006UMQ
Chemical Name:
1H-Indole, 4,5,6,7-tetrahydro-1-(4-methoxyphenyl)-2-phenyl-
CAS Number:
52351-43-6
Molecular Formula:
C21H21NO
Molecular Weight:
303.3975
IUPAC Name:
1-(4-methoxyphenyl)-2-phenyl-4,5,6,7-tetrahydroindole
InChI:
InChI=1S/C21H21NO/c1-23-19-13-11-18(12-14-19)22-20-10-6-5-9-17(20)15-21(22)16-7-3-2-4-8-16/h2-4,7-8,11-15H,5-6,9-10H2,1H3
InChI Key:
ZGSFIINXHVEGBM-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)n1c2CCCCc2cc1c1ccccc1
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.162g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.405g/mol
Monoisotopic Mass:
303.162g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
14.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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