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Home > Pyridines > 125927-26-6
125927-26-6 | Pyridine, 1,2,3,6-tetrahydro-1-methyl-4-(phenylmethyl)-, hydrochloride (1:1)
CAS No: 125927-26-6 Catalog No: AG000OZG MDL No:
Product Description
Catalog Number:
AG000OZG
Chemical Name:
Pyridine, 1,2,3,6-tetrahydro-1-methyl-4-(phenylmethyl)-, hydrochloride (1:1)
CAS Number:
125927-26-6
Molecular Formula:
C13H18ClN
Molecular Weight:
223.7417
IUPAC Name:
4-benzyl-1-methyl-3,6-dihydro-2H-pyridine
InChI:
InChI=1S/C13H17N/c1-14-9-7-13(8-10-14)11-12-5-3-2-4-6-12/h2-7H,8-11H2,1H3
InChI Key:
ARYZGNSJMRABMB-UHFFFAOYSA-N
SMILES:
CN1CCC(=CC1)Cc1ccccc1.Cl
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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