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Home > Other Heterocycles > 100234-38-6
100234-38-6 | 1,4,6-Trioxaspiro[4.6]undecane, 2-(phenoxymethyl)-
CAS No: 100234-38-6 Catalog No: AG0001BU MDL No:
Product Description
Catalog Number:
AG0001BU
Chemical Name:
1,4,6-Trioxaspiro[4.6]undecane, 2-(phenoxymethyl)-
CAS Number:
100234-38-6
Molecular Formula:
C15H20O4
Molecular Weight:
264.3169
IUPAC Name:
3-(phenoxymethyl)-1,4,11-trioxaspiro[4.6]undecane
InChI:
InChI=1S/C15H20O4/c1-3-7-13(8-4-1)16-11-14-12-18-15(19-14)9-5-2-6-10-17-15/h1,3-4,7-8,14H,2,5-6,9-12H2
InChI Key:
ULKFBMHAPLTVLO-UHFFFAOYSA-N
SMILES:
C1CCOC2(CC1)OCC(O2)COc1ccccc1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.136g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.321g/mol
Monoisotopic Mass:
264.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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