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Home > Other Heterocycles > 115562-72-6
115562-72-6 | 1,4-Dioxaspiro[4.5]dec-6-ene-6-methanol
CAS No: 115562-72-6 Catalog No: AG000G5U MDL No:
Product Description
Catalog Number:
AG000G5U
Chemical Name:
1,4-Dioxaspiro[4.5]dec-6-ene-6-methanol
CAS Number:
115562-72-6
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
IUPAC Name:
1,4-dioxaspiro[4.5]dec-6-en-6-ylmethanol
InChI:
InChI=1S/C9H14O3/c10-7-8-3-1-2-4-9(8)11-5-6-12-9/h3,10H,1-2,4-7H2
InChI Key:
FFXABPAJYMWCTC-UHFFFAOYSA-N
SMILES:
OCC1=CCCCC21OCCO2
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.094g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.208g/mol
Monoisotopic Mass:
170.094g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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