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137180-64-4 | 1-Oxaspiro[4.5]decan-2-one, 4-(2-chloroacetyl)-
CAS No: 137180-64-4 Catalog No: AG0012X5 MDL No:
Product Description
Catalog Number:
AG0012X5
Chemical Name:
1-Oxaspiro[4.5]decan-2-one, 4-(2-chloroacetyl)-
CAS Number:
137180-64-4
Molecular Formula:
C11H15ClO3
Molecular Weight:
230.6880
IUPAC Name:
4-(2-chloroacetyl)-1-oxaspiro[4.5]decan-2-one
InChI:
InChI=1S/C11H15ClO3/c12-7-9(13)8-6-10(14)15-11(8)4-2-1-3-5-11/h8H,1-7H2
InChI Key:
PKSKXRXSHMEHSH-UHFFFAOYSA-N
SMILES:
ClCC(=O)C1CC(=O)OC21CCCCC2
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.071g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.688g/mol
Monoisotopic Mass:
230.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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