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Home > Indoles and Oxindole > 27503-29-3
27503-29-3 | Phenol, 4-(4,5,6,7-tetrahydro-2-phenyl-1H-indol-1-yl)-
CAS No: 27503-29-3 Catalog No: AG002TXY MDL No:
Product Description
Catalog Number:
AG002TXY
Chemical Name:
Phenol, 4-(4,5,6,7-tetrahydro-2-phenyl-1H-indol-1-yl)-
CAS Number:
27503-29-3
Molecular Formula:
C20H19NO
Molecular Weight:
289.3710
IUPAC Name:
4-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)phenol
InChI:
InChI=1S/C20H19NO/c22-18-12-10-17(11-13-18)21-19-9-5-4-8-16(19)14-20(21)15-6-2-1-3-7-15/h1-3,6-7,10-14,22H,4-5,8-9H2
InChI Key:
BQKVKRBUXODOHS-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)n1c2CCCCc2cc1c1ccccc1
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.147g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.378g/mol
Monoisotopic Mass:
289.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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