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Home > Other Heterocycles > 88664-56-6
88664-56-6 | 1,6-Dioxaspiro[4.4]nonane, 2-methyl-2-[(phenylmethoxy)methyl]-
CAS No: 88664-56-6 Catalog No: AG0047P0 MDL No:
Product Description
Catalog Number:
AG0047P0
Chemical Name:
1,6-Dioxaspiro[4.4]nonane, 2-methyl-2-[(phenylmethoxy)methyl]-
CAS Number:
88664-56-6
Molecular Formula:
C16H22O3
Molecular Weight:
262.3441
IUPAC Name:
2-methyl-2-(phenylmethoxymethyl)-1,6-dioxaspiro[4.4]nonane
InChI:
InChI=1S/C16H22O3/c1-15(9-10-16(19-15)8-5-11-18-16)13-17-12-14-6-3-2-4-7-14/h2-4,6-7H,5,8-13H2,1H3
InChI Key:
SYUQICGCTMOXEI-UHFFFAOYSA-N
SMILES:
CC1(COCc2ccccc2)CCC2(O1)CCCO2
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.157g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.349g/mol
Monoisotopic Mass:
262.157g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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