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Home > Other Heterocycles > 656835-41-5
656835-41-5 | 2,4-Dioxaspiro[5.5]undec-9-en-8-ol, 10-(1-hexenyl)-3,3-dimethyl-
CAS No: 656835-41-5 Catalog No: AG006PPT MDL No:
Product Description
Catalog Number:
AG006PPT
Chemical Name:
2,4-Dioxaspiro[5.5]undec-9-en-8-ol, 10-(1-hexenyl)-3,3-dimethyl-
CAS Number:
656835-41-5
Molecular Formula:
C17H28O3
Molecular Weight:
280.4024
IUPAC Name:
10-hex-1-enyl-3,3-dimethyl-2,4-dioxaspiro[5.5]undec-9-en-8-ol
InChI:
InChI=1S/C17H28O3/c1-4-5-6-7-8-14-9-15(18)11-17(10-14)12-19-16(2,3)20-13-17/h7-9,15,18H,4-6,10-13H2,1-3H3
InChI Key:
SRMAGSZOBPFPHD-UHFFFAOYSA-N
SMILES:
CCCCC=CC1=CC(O)CC2(C1)COC(OC2)(C)C
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.204g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.408g/mol
Monoisotopic Mass:
280.204g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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