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Home > Other Heterocycles > 97773-09-6
97773-09-6 | 2-Propenoic acid, 1,4-dioxaspiro[4.5]dec-2-ylmethyl ester
CAS No: 97773-09-6 Catalog No: AG006AXG MDL No:
Product Description
Catalog Number:
AG006AXG
Chemical Name:
2-Propenoic acid, 1,4-dioxaspiro[4.5]dec-2-ylmethyl ester
CAS Number:
97773-09-6
Molecular Formula:
C12H18O4
Molecular Weight:
226.2689
IUPAC Name:
1,4-dioxaspiro[4.5]decan-3-ylmethyl prop-2-enoate
InChI:
InChI=1S/C12H18O4/c1-2-11(13)14-8-10-9-15-12(16-10)6-4-3-5-7-12/h2,10H,1,3-9H2
InChI Key:
PBZQCLTYWHSQDF-UHFFFAOYSA-N
SMILES:
C=CC(=O)OCC1COC2(O1)CCCCC2
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.272g/mol
Monoisotopic Mass:
226.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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