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Home > Quinoline > 118864-75-8
118864-75-8 | (S)-1-Phenyl-1,2,3,4-tetrahydroisoquinoline
CAS No: 118864-75-8 Catalog No: AG0080T1 MDL No:MFCD08692036
Product Description
Catalog Number:
AG0080T1
Chemical Name:
(S)-1-Phenyl-1,2,3,4-tetrahydroisoquinoline
CAS Number:
118864-75-8
Molecular Formula:
C15H15N
Molecular Weight:
209.2863
MDL Number:
MFCD08692036
IUPAC Name:
(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
InChI Key:
PRTRSEDVLBBFJZ-HNNXBMFYSA-N
SMILES:
c1ccc(cc1)[C@@H]1NCCc2c1cccc2
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
209.12g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.292g/mol
Monoisotopic Mass:
209.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Neuromuscular blocking activity and therapeutic potential of mixed-tetrahydroisoquinolinium halofumarates and halosuccinates in rhesus monkeys. | Journal of medicinal chemistry 20030605 |
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