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88855-13-4 | 4H-1,3-Dioxino[4,5-c]pyridine, 2,2,5,8-tetramethyl-6-phenyl-
CAS No: 88855-13-4 Catalog No: AG004A4V MDL No:
Product Description
Catalog Number:
AG004A4V
Chemical Name:
4H-1,3-Dioxino[4,5-c]pyridine, 2,2,5,8-tetramethyl-6-phenyl-
CAS Number:
88855-13-4
Molecular Formula:
C17H19NO2
Molecular Weight:
269.3383
IUPAC Name:
2,2,5,8-tetramethyl-6-phenyl-4H-[1,3]dioxino[4,5-c]pyridine
InChI:
InChI=1S/C17H19NO2/c1-11-14-10-19-17(3,4)20-16(14)12(2)18-15(11)13-8-6-5-7-9-13/h5-9H,10H2,1-4H3
InChI Key:
KPMLYLYFVIVYDU-UHFFFAOYSA-N
SMILES:
Cc1c(nc(c2c1COC(O2)(C)C)C)c1ccccc1
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.142g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.344g/mol
Monoisotopic Mass:
269.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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