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Home > Pyridines > 158878-53-6
158878-53-6 | 5-phenyl-1,2,3,6-tetrahydropyridine
CAS No: 158878-53-6 Catalog No: AG01B9RA MDL No:MFCD20684030
Product Description
Catalog Number:
AG01B9RA
Chemical Name:
5-phenyl-1,2,3,6-tetrahydropyridine
CAS Number:
158878-53-6
Molecular Formula:
C11H13N
Molecular Weight:
159.2276
MDL Number:
MFCD20684030
IUPAC Name:
5-phenyl-1,2,3,6-tetrahydropyridine
InChI:
InChI=1S/C11H13N/c1-2-5-10(6-3-1)11-7-4-8-12-9-11/h1-3,5-7,12H,4,8-9H2
InChI Key:
ZKGZDIKALAEIGH-UHFFFAOYSA-N
SMILES:
N1CCC=C(C1)c1ccccc1
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.105g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.232g/mol
Monoisotopic Mass:
159.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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