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Home > Pyridines > 166401-49-6
166401-49-6 | 4-(2-methylphenyl)-1,2,3,6-tetrahydropyridine
CAS No: 166401-49-6 Catalog No: AG01A6JN MDL No:MFCD08689317
Product Description
Catalog Number:
AG01A6JN
Chemical Name:
4-(2-methylphenyl)-1,2,3,6-tetrahydropyridine
CAS Number:
166401-49-6
Molecular Formula:
C12H15N
Molecular Weight:
173.2542
MDL Number:
MFCD08689317
IUPAC Name:
4-(2-methylphenyl)-1,2,3,6-tetrahydropyridine
InChI:
InChI=1S/C12H15N/c1-10-4-2-3-5-12(10)11-6-8-13-9-7-11/h2-6,13H,7-9H2,1H3
InChI Key:
FXAXMQLMMSURHQ-UHFFFAOYSA-N
SMILES:
Cc1ccccc1C1=CCNCC1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.12g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.259g/mol
Monoisotopic Mass:
173.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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