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Home > Pyridines > 114284-26-3
114284-26-3 | Pyridine, 1,2,3,6-tetrahydro-4-(4-methoxyphenyl)-1-methyl-
CAS No: 114284-26-3 Catalog No: AG000AYR MDL No:
Product Description
Catalog Number:
AG000AYR
Chemical Name:
Pyridine, 1,2,3,6-tetrahydro-4-(4-methoxyphenyl)-1-methyl-
CAS Number:
114284-26-3
Molecular Formula:
C13H17NO
Molecular Weight:
203.2802
IUPAC Name:
4-(4-methoxyphenyl)-1-methyl-3,6-dihydro-2H-pyridine
InChI:
InChI=1S/C13H17NO/c1-14-9-7-12(8-10-14)11-3-5-13(15-2)6-4-11/h3-7H,8-10H2,1-2H3
InChI Key:
MTTSRPOEHMMBGE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1=CCN(CC1)C
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.285g/mol
Monoisotopic Mass:
203.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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