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Home > Pyridines > 123004-53-5
123004-53-5 | Pyridine, 1,2,3,6-tetrahydro-4-(3-methoxyphenyl)-1,5-dimethyl-
CAS No: 123004-53-5 Catalog No: AG000JYE MDL No:
Product Description
Catalog Number:
AG000JYE
Chemical Name:
Pyridine, 1,2,3,6-tetrahydro-4-(3-methoxyphenyl)-1,5-dimethyl-
CAS Number:
123004-53-5
Molecular Formula:
C14H19NO
Molecular Weight:
217.3068
IUPAC Name:
4-(3-methoxyphenyl)-1,5-dimethyl-3,6-dihydro-2H-pyridine
InChI:
InChI=1S/C14H19NO/c1-11-10-15(2)8-7-14(11)12-5-4-6-13(9-12)16-3/h4-6,9H,7-8,10H2,1-3H3
InChI Key:
FAXSYIMYVUFDIN-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C1=C(C)CN(CC1)C
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.312g/mol
Monoisotopic Mass:
217.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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