Home Other Building Blocks Pyridine, 1,2,3,6-tetrahydro-4-[2-(trifluoromethyl)phenyl]-, hydrochloride (1:1)

Pyridine, 1,2,3,6-tetrahydro-4-[2-(trifluoromethyl)phenyl]-, hydrochloride (1:1)

CAS No.:
208989-34-8
Catalog Number:
AG002JZX
Molecular Formula:
C12H13ClF3N
Molecular Weight:
263.6865
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Product Description
Catalog Number:
AG002JZX
Chemical Name:
Pyridine, 1,2,3,6-tetrahydro-4-[2-(trifluoromethyl)phenyl]-, hydrochloride (1:1)
CAS Number:
208989-34-8
Molecular Formula:
C12H13ClF3N
Molecular Weight:
263.6865
MDL Number:
MFCD22378606
IUPAC Name:
4-[2-(trifluoromethyl)phenyl]-1,2,3,6-tetrahydropyridine;hydrochloride
InChI:
InChI=1S/C12H12F3N.ClH/c13-12(14,15)11-4-2-1-3-10(11)9-5-7-16-8-6-9;/h1-5,16H,6-8H2;1H
InChI Key:
TWDUMXUCXGJUCT-UHFFFAOYSA-N
SMILES:
FC(c1ccccc1C1=CCNCC1)(F)F.Cl
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.069g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
263.688g/mol
Monoisotopic Mass:
263.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties