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102441-39-4 | 1H-Indole-3-ethanamine, β,2-diphenyl-
CAS No: 102441-39-4 Catalog No: AG0007IY MDL No:MFCD03988751
Product Description
Catalog Number:
AG0007IY
Chemical Name:
1H-Indole-3-ethanamine, β,2-diphenyl-
CAS Number:
102441-39-4
Molecular Formula:
C22H20N2
Molecular Weight:
312.4076
MDL Number:
MFCD03988751
IUPAC Name:
2-phenyl-2-(2-phenyl-1H-indol-3-yl)ethanamine;hydrochloride
InChI:
InChI=1S/C22H20N2.ClH/c23-15-19(16-9-3-1-4-10-16)21-18-13-7-8-14-20(18)24-22(21)17-11-5-2-6-12-17;/h1-14,19,24H,15,23H2;1H
InChI Key:
IGUKHNBKUNNETI-UHFFFAOYSA-N
SMILES:
NCC(c1c([nH]c2c1cccc2)c1ccccc1)c1ccccc1
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.139g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
348.874g/mol
Monoisotopic Mass:
348.139g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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