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Home > Other Heterocycles > 7463-17-4
7463-17-4 | 2,2,5,5-tetramethyl-1,4-diphenyl-3,6,7-trioxabicyclo[2.2.1]heptane
CAS No: 7463-17-4 Catalog No: AG005VXS MDL No:
Product Description
Catalog Number:
AG005VXS
Chemical Name:
2,2,5,5-tetramethyl-1,4-diphenyl-3,6,7-trioxabicyclo[2.2.1]heptane
CAS Number:
7463-17-4
Molecular Formula:
C20H22O3
Molecular Weight:
310.3869
IUPAC Name:
3,3,6,6-tetramethyl-1,4-diphenyl-2,5,7-trioxabicyclo[2.2.1]heptane
InChI:
InChI=1S/C20H22O3/c1-17(2)19(15-11-7-5-8-12-15)22-18(3,4)20(21-17,23-19)16-13-9-6-10-14-16/h5-14H,1-4H3
InChI Key:
OAXCZVFPZDWDIU-UHFFFAOYSA-N
SMILES:
CC1(C)OC2(OC1(OC2(C)C)c1ccccc1)c1ccccc1
NSC Number:
402146
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.157g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.393g/mol
Monoisotopic Mass:
310.157g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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