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Home > Other Heterocycles > 88329-27-5
88329-27-5 | 1-Oxaspiro[2.5]octane, 6-(1,1-dimethylethyl)-2-(2-phenylethenyl)-
CAS No: 88329-27-5 Catalog No: AG0047CL MDL No:
Product Description
Catalog Number:
AG0047CL
Chemical Name:
1-Oxaspiro[2.5]octane, 6-(1,1-dimethylethyl)-2-(2-phenylethenyl)-
CAS Number:
88329-27-5
Molecular Formula:
C19H26O
Molecular Weight:
270.4091
IUPAC Name:
6-tert-butyl-2-(2-phenylethenyl)-1-oxaspiro[2.5]octane
InChI:
InChI=1S/C19H26O/c1-18(2,3)16-11-13-19(14-12-16)17(20-19)10-9-15-7-5-4-6-8-15/h4-10,16-17H,11-14H2,1-3H3
InChI Key:
VHBJGKDRQNEWND-UHFFFAOYSA-N
SMILES:
CC(C1CCC2(CC1)OC2C=Cc1ccccc1)(C)C
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.198g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.416g/mol
Monoisotopic Mass:
270.198g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
5.1
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