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92474-80-1 | 4-METHYLENE-1,3-DIOXASPIRO[4.5]DECAN-2-ONE
CAS No: 92474-80-1 Catalog No: AG006HUX MDL No:MFCD01593659
Product Description
Catalog Number:
AG006HUX
Chemical Name:
4-METHYLENE-1,3-DIOXASPIRO[4.5]DECAN-2-ONE
CAS Number:
92474-80-1
Molecular Formula:
C9H12O3
Molecular Weight:
168.1898
MDL Number:
MFCD01593659
IUPAC Name:
4-methylidene-1,3-dioxaspiro[4.5]decan-2-one
InChI:
InChI=1S/C9H12O3/c1-7-9(12-8(10)11-7)5-3-2-4-6-9/h1-6H2
InChI Key:
CJCSXIURLVVZLZ-UHFFFAOYSA-N
SMILES:
C=C1OC(=O)OC21CCCCC2
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.192g/mol
Monoisotopic Mass:
168.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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