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Home > Other Heterocycles > 226548-25-0
226548-25-0 | 7,7-DIMETHYLSPIRO[2.5]OCTAN-5-ONE
CAS No: 226548-25-0 Catalog No: AG01BNN3 MDL No:MFCD24711645
Product Description
Catalog Number:
AG01BNN3
Chemical Name:
7,7-DIMETHYLSPIRO[2.5]OCTAN-5-ONE
CAS Number:
226548-25-0
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
MDL Number:
MFCD24711645
IUPAC Name:
7,7-dimethylspiro[2.5]octan-5-one
InChI:
InChI=1S/C10H16O/c1-9(2)5-8(11)6-10(7-9)3-4-10/h3-7H2,1-2H3
InChI Key:
YHOKAHHPKRVWKQ-UHFFFAOYSA-N
SMILES:
O=C1CC(C)(C)CC2(C1)CC2
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.12g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.237g/mol
Monoisotopic Mass:
152.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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