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3-benzyl-1H-indole

3-benzyl-1H-indole

CAS: 16886-10-5

Formula: C15H13N

SMILES: C(C1=CNC2=CC=CC=C12)C1=CC=CC=C1

IUPAC: 3-benzyl-1H-indole

InChI: InChI=1S/C15H13N/c1-2-6-12(7-3-1)10-13-11-16-15-9-5-4-8-14(13)15/h1-9,11,16H,10H2

Composition: C (86.92%), H (6.32%), N (6.76%)

Molar Mass: 207.276

Atom Count: 29

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 207.104799423
Formal Charge 0
FSP3 0.07
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 1
InChIKey HNUYRDWMYRCVNO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.88
Topological Polar Surface Area 15.79
Polarizability 27.07
Ring Count 3
Rotatable Bond Count 2

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