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Home > Other Heterocycles > 79402-31-6
79402-31-6 | Spiro[3.5]non-5-en-1-one, 5-methyl-
CAS No: 79402-31-6 Catalog No: AG0058UX MDL No:
Product Description
Catalog Number:
AG0058UX
Chemical Name:
Spiro[3.5]non-5-en-1-one, 5-methyl-
CAS Number:
79402-31-6
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
IUPAC Name:
9-methylspiro[3.5]non-8-en-3-one
InChI:
InChI=1S/C10H14O/c1-8-4-2-3-6-10(8)7-5-9(10)11/h4H,2-3,5-7H2,1H3
InChI Key:
OXPOWLPQMUNFDI-UHFFFAOYSA-N
SMILES:
O=C1CCC21CCCC=C2C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.104g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.221g/mol
Monoisotopic Mass:
150.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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