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Home > Indoles and Oxindole > 33948-97-9
33948-97-9 | Phenol, 2-(di-1H-indol-3-ylmethyl)-
CAS No: 33948-97-9 Catalog No: AG007IC1 MDL No:
Product Description
Catalog Number:
AG007IC1
Chemical Name:
Phenol, 2-(di-1H-indol-3-ylmethyl)-
CAS Number:
33948-97-9
Molecular Formula:
C23H18N2O
Molecular Weight:
338.4018
IUPAC Name:
2-[bis(1H-indol-3-yl)methyl]phenol
InChI:
InChI=1S/C23H18N2O/c26-22-12-6-3-9-17(22)23(18-13-24-20-10-4-1-7-15(18)20)19-14-25-21-11-5-2-8-16(19)21/h1-14,23-26H
InChI Key:
RMICSEYOBOALHT-UHFFFAOYSA-N
SMILES:
Oc1ccccc1C(c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.142g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
338.41g/mol
Monoisotopic Mass:
338.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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