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Home > Other Heterocycles > 88400-77-5
88400-77-5 | 1,4-Dioxaspiro[4.4]nonane, 6-(3-methoxypropyl)-6,8,8-trimethyl-
CAS No: 88400-77-5 Catalog No: AG004IAN MDL No:
Product Description
Catalog Number:
AG004IAN
Chemical Name:
1,4-Dioxaspiro[4.4]nonane, 6-(3-methoxypropyl)-6,8,8-trimethyl-
CAS Number:
88400-77-5
Molecular Formula:
C14H26O3
Molecular Weight:
242.3544
IUPAC Name:
9-(3-methoxypropyl)-7,7,9-trimethyl-1,4-dioxaspiro[4.4]nonane
InChI:
InChI=1S/C14H26O3/c1-12(2)10-13(3,6-5-7-15-4)14(11-12)16-8-9-17-14/h5-11H2,1-4H3
InChI Key:
QUXKMAYUNHSEJN-UHFFFAOYSA-N
SMILES:
COCCCC1(C)CC(CC21OCCO2)(C)C
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.188g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.359g/mol
Monoisotopic Mass:
242.188g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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