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(1S)-1-phenyl-1,2,3,4-tetrahydroisoquinoline

(1S)-1-phenyl-1,2,3,4-tetrahydroisoquinoline

CAS: 118864-75-8

Formula: C15H15N

SMILES: C1CC2=C(C=CC=C2)[C@@H](N1)C1=CC=CC=C1

IUPAC: (1S)-1-phenyl-1,2,3,4-tetrahydroisoquinoline

InChI: InChI=1S/C15H15N/c1-2-7-13(8-3-1)15-14-9-5-4-6-12(14)10-11-16-15/h1-9,15-16H,10-11H2/t15-/m0/s1

Composition: C (86.08%), H (7.22%), N (6.69%)

Molar Mass: 209.292

Atom Count: 31

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 209.120449487
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey PRTRSEDVLBBFJZ-HNNXBMFYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.9
Topological Polar Surface Area 12.03
Polarizability 26.25
Ring Count 3
Rotatable Bond Count 1

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