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Home > Pyridines > 804428-16-8
804428-16-8 | 4-(2,4-DIMETHYL-PHENYL)-1,2,3,6-TETRAHYDRO-PYRIDINE
CAS No: 804428-16-8 Catalog No: AG01DT02 MDL No:MFCD08689319
Product Description
Catalog Number:
AG01DT02
Chemical Name:
4-(2,4-DIMETHYL-PHENYL)-1,2,3,6-TETRAHYDRO-PYRIDINE
CAS Number:
804428-16-8
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
MDL Number:
MFCD08689319
IUPAC Name:
4-(2,4-dimethylphenyl)-1,2,3,6-tetrahydropyridine
InChI:
InChI=1S/C13H17N/c1-10-3-4-13(11(2)9-10)12-5-7-14-8-6-12/h3-5,9,14H,6-8H2,1-2H3
InChI Key:
HOTDVWIFUZHTMH-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C)C1=CCNCC1
Properties
Complexity:
219
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:
1
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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