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Home > Pyridines > 1443118-08-8
1443118-08-8 | 1-benzyl-4-tert-butyl-1,2,3,6-tetrahydropyridine
CAS No: 1443118-08-8 Catalog No: AG01B1KI MDL No:MFCD28012221
Product Description
Catalog Number:
AG01B1KI
Chemical Name:
1-benzyl-4-tert-butyl-1,2,3,6-tetrahydropyridine
CAS Number:
1443118-08-8
Molecular Formula:
C16H23N
Molecular Weight:
229.3605
MDL Number:
MFCD28012221
IUPAC Name:
1-benzyl-4-tert-butyl-3,6-dihydro-2H-pyridine
InChI:
InChI=1S/C16H23N/c1-16(2,3)15-9-11-17(12-10-15)13-14-7-5-4-6-8-14/h4-9H,10-13H2,1-3H3
InChI Key:
SPPXJHQQQIHSGX-UHFFFAOYSA-N
SMILES:
CC(C1=CCN(CC1)Cc1ccccc1)(C)C
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.183g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.367g/mol
Monoisotopic Mass:
229.183g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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