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89746-09-8 | Pyridinium, 4-methoxy-1,2,6-trimethyl-
CAS No: 89746-09-8 Catalog No: AG0040N6 MDL No:
Product Description
Catalog Number:
AG0040N6
Chemical Name:
Pyridinium, 4-methoxy-1,2,6-trimethyl-
CAS Number:
89746-09-8
Molecular Formula:
C9H14NO+
Molecular Weight:
152.2136
IUPAC Name:
4-methoxy-1,2,6-trimethylpyridin-1-ium
InChI:
InChI=1S/C9H14NO/c1-7-5-9(11-4)6-8(2)10(7)3/h5-6H,1-4H3/q+1
InChI Key:
RYGFFLOFOWEBKL-UHFFFAOYSA-N
SMILES:
COc1cc(C)[n+](c(c1)C)C
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.108g/mol
Formal Charge:
1
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.217g/mol
Monoisotopic Mass:
152.108g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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