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84473-59-6

84473-59-6 | Pyridine,1,2,3,4-tetrahydro-4-phenyl-, hydrochloride (1:1)

CAS No: 84473-59-6 Catalog No: AG00550L MDL No:

Product Description

Catalog Number:
AG00550L
Chemical Name:
Pyridine,1,2,3,4-tetrahydro-4-phenyl-, hydrochloride (1:1)
CAS Number:
84473-59-6
Molecular Formula:
C11H14ClN
Molecular Weight:
195.6886
IUPAC Name:
4-phenyl-1,2,3,4-tetrahydropyridin-1-ium;chloride
InChI:
InChI=1S/C11H13N.ClH/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;/h1-6,8,11-12H,7,9H2;1H
InChI Key:
JBZWJMSEWXZHOS-UHFFFAOYSA-N
SMILES:
[NH2+]1CCC(C=C1)c1ccccc1.[Cl-]
EC Number:
282-913-6

Properties

Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.081g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.69g/mol
Monoisotopic Mass:
195.081g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
16.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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