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1489-97-0 | 1,4-Dioxaspiro[4.5]decane-8-carboxylic acid, ethyl ester
CAS No: 1489-97-0 Catalog No: AG001LA6 MDL No:MFCD00205582
Product Description
Catalog Number:
AG001LA6
Chemical Name:
1,4-Dioxaspiro[4.5]decane-8-carboxylic acid, ethyl ester
CAS Number:
1489-97-0
Molecular Formula:
C11H18O4
Molecular Weight:
214.2582
MDL Number:
MFCD00205582
IUPAC Name:
ethyl 1,4-dioxaspiro[4.5]decane-8-carboxylate
InChI:
InChI=1S/C11H18O4/c1-2-13-10(12)9-3-5-11(6-4-9)14-7-8-15-11/h9H,2-8H2,1H3
InChI Key:
UXXWGBLTOSRBAY-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCC2(CC1)OCCO2
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.261g/mol
Monoisotopic Mass:
214.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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