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Home > Other Heterocycles > 1443981-62-1
1443981-62-1 | 3-ethoxy-5-oxaspiro[3.4]octan-1-one
CAS No: 1443981-62-1 Catalog No: AG01A5U3 MDL No:MFCD24843038
Product Description
Catalog Number:
AG01A5U3
Chemical Name:
3-ethoxy-5-oxaspiro[3.4]octan-1-one
CAS Number:
1443981-62-1
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
MDL Number:
MFCD24843038
IUPAC Name:
1-ethoxy-5-oxaspiro[3.4]octan-3-one
InChI:
InChI=1S/C9H14O3/c1-2-11-8-6-7(10)9(8)4-3-5-12-9/h8H,2-6H2,1H3
InChI Key:
GSYAMIGDGVVWAF-UHFFFAOYSA-N
SMILES:
CCOC1CC(=O)C21CCCO2
Properties
Complexity:
202
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:
0
Isotope Atom Count:
0
Molecular Weight:
170.208g/mol
Monoisotopic Mass:
170.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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