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Home > Pyridines > 64811-09-2

64811-09-2

64811-09-2 | Pyridinium, 1-methyl-4-(2-phenylethenyl)-, chloride

CAS No: 64811-09-2 Catalog No: AG00H60P MDL No:

Product Description

Catalog Number:
AG00H60P
Chemical Name:
Pyridinium, 1-methyl-4-(2-phenylethenyl)-, chloride
CAS Number:
64811-09-2
Molecular Formula:
C14H14ClN
Molecular Weight:
231.7207
IUPAC Name:
1-methyl-4-(2-phenylethenyl)pyridin-1-ium;chloride
InChI:
InChI=1S/C14H14N.ClH/c1-15-11-9-14(10-12-15)8-7-13-5-3-2-4-6-13;/h2-12H,1H3;1H/q+1;/p-1
InChI Key:
IFSZZFJEEGEBOM-UHFFFAOYSA-M
SMILES:
C[n+]1ccc(cc1)C=Cc1ccccc1.[Cl-]

Properties

Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.081g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.723g/mol
Monoisotopic Mass:
231.081g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  

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