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Home > Other Heterocycles > 2059970-72-6
2059970-72-6 | {2,7-dioxaspiro[4.4]nonan-3-yl}methanol
CAS No: 2059970-72-6 Catalog No: AG01BRD7 MDL No:MFCD30502464
Product Description
Catalog Number:
AG01BRD7
Chemical Name:
{2,7-dioxaspiro[4.4]nonan-3-yl}methanol
CAS Number:
2059970-72-6
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
MDL Number:
MFCD30502464
IUPAC Name:
2,7-dioxaspiro[4.4]nonan-3-ylmethanol
InChI:
InChI=1S/C8H14O3/c9-4-7-3-8(6-11-7)1-2-10-5-8/h7,9H,1-6H2
InChI Key:
QXIFFZDBGIODGF-UHFFFAOYSA-N
SMILES:
OCC1OCC2(C1)COCC2
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.094g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.197g/mol
Monoisotopic Mass:
158.094g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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