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141240-65-5 | Pyridinium, 1-phenoxy-
CAS No: 141240-65-5 Catalog No: AG001G4W MDL No:
Product Description
Catalog Number:
AG001G4W
Chemical Name:
Pyridinium, 1-phenoxy-
CAS Number:
141240-65-5
Molecular Formula:
C11H10NO+
Molecular Weight:
172.2032
IUPAC Name:
1-phenoxypyridin-1-ium
InChI:
InChI=1S/C11H10NO/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10H/q+1
InChI Key:
MZBKQJKKHLVSSW-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)O[n+]1ccccc1
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.076g/mol
Formal Charge:
1
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.207g/mol
Monoisotopic Mass:
172.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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