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827607-31-8 | 2-Propenoic acid,hexahydro-3,5-methano-2H-cyclopenta[b]furan-6-yl ester
CAS No: 827607-31-8 Catalog No: AG008IR3 MDL No:
Product Description
Catalog Number:
AG008IR3
Chemical Name:
2-Propenoic acid,hexahydro-3,5-methano-2H-cyclopenta[b]furan-6-yl ester
CAS Number:
827607-31-8
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
IUPAC Name:
4-oxatricyclo[4.2.1.03,7]nonan-2-yl prop-2-enoate
InChI:
InChI=1S/C11H14O3/c1-2-9(12)14-10-6-3-7-5-13-11(10)8(7)4-6/h2,6-8,10-11H,1,3-5H2
InChI Key:
CSCOOXQHDVXIBI-UHFFFAOYSA-N
SMILES:
C=CC(=O)OC1C2CC3C(C1OC3)C2
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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