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Home > Other Heterocycles > 16133-64-5
16133-64-5 | Spiro[bicyclo[2.2.1]heptane-2,1'-cyclopropan]-3-one
CAS No: 16133-64-5 Catalog No: AG001SD9 MDL No:
Product Description
Catalog Number:
AG001SD9
Chemical Name:
Spiro[bicyclo[2.2.1]heptane-2,1'-cyclopropan]-3-one
CAS Number:
16133-64-5
Molecular Formula:
C9H12O
Molecular Weight:
136.1910
IUPAC Name:
spiro[bicyclo[2.2.1]heptane-3,1'-cyclopropane]-2-one
InChI:
InChI=1S/C9H12O/c10-8-6-1-2-7(5-6)9(8)3-4-9/h6-7H,1-5H2
InChI Key:
ZYFYCMULISNLFT-UHFFFAOYSA-N
SMILES:
O=C1C2CCC(C31CC3)C2
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.089g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.194g/mol
Monoisotopic Mass:
136.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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