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827607-39-6 | 2-Propenoic acid, hexahydro-2,6-methanofuro[3,2-b]furan-3-yl ester
CAS No: 827607-39-6 Catalog No: AG0056ZU MDL No:
Product Description
Catalog Number:
AG0056ZU
Chemical Name:
2-Propenoic acid, hexahydro-2,6-methanofuro[3,2-b]furan-3-yl ester
CAS Number:
827607-39-6
Molecular Formula:
C10H12O4
Molecular Weight:
196.1999
IUPAC Name:
4,8-dioxatricyclo[4.2.1.03,7]nonan-2-yl prop-2-enoate
InChI:
InChI=1S/C10H12O4/c1-2-7(11)14-9-6-3-5-4-12-10(9)8(5)13-6/h2,5-6,8-10H,1,3-4H2
InChI Key:
DCAJCYYLQJNZBU-UHFFFAOYSA-N
SMILES:
C=CC(=O)OC1C2CC3C(C1OC3)O2
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.202g/mol
Monoisotopic Mass:
196.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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