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Home > Other Heterocycles > 88982-06-3
88982-06-3 | Spiro[2.5]octan-4-one, 5-methyl-
CAS No: 88982-06-3 Catalog No: AG0045K6 MDL No:
Product Description
Catalog Number:
AG0045K6
Chemical Name:
Spiro[2.5]octan-4-one, 5-methyl-
CAS Number:
88982-06-3
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
IUPAC Name:
7-methylspiro[2.5]octan-8-one
InChI:
InChI=1S/C9H14O/c1-7-3-2-4-9(5-6-9)8(7)10/h7H,2-6H2,1H3
InChI Key:
VKZWWNCOURAWPM-UHFFFAOYSA-N
SMILES:
CC1CCCC2(C1=O)CC2
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.104g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.21g/mol
Monoisotopic Mass:
138.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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