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Home > Aldehydes > 132945-26-7
132945-26-7 | 3-Oxatricyclo[3.2.1.02,4]octane-6-carboxaldehyde (9CI)
CAS No: 132945-26-7 Catalog No: AG0011F7 MDL No:
Product Description
Catalog Number:
AG0011F7
Chemical Name:
3-Oxatricyclo[3.2.1.02,4]octane-6-carboxaldehyde (9CI)
CAS Number:
132945-26-7
Molecular Formula:
C8H10O2
Molecular Weight:
138.1638
IUPAC Name:
3-oxatricyclo[3.2.1.02,4]octane-6-carbaldehyde
InChI:
InChI=1S/C8H10O2/c9-3-5-1-4-2-6(5)8-7(4)10-8/h3-8H,1-2H2
InChI Key:
FFYSZYBEDUPTAU-UHFFFAOYSA-N
SMILES:
O=CC1CC2CC1C1C2O1
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.166g/mol
Monoisotopic Mass:
138.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.6A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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