2-Cyclohexen-1-one, 2-methyl-3-(2-methylpropoxy)-
Basic information
- CAS
37457-15-1- Standard SMILES
CC1=C(OCC(C)C)CCCC1=O- InChIKey
GIAZBUMIVSZJNX-UHFFFAOYSA-N- Molecular formula
- C11H18O2
- Average molar mass
- 182.26 g/mol
- Monoisotopic mass
- 182.13067981
Names & identifiers
- Preferred name
- 2-Cyclohexen-1-one, 2-methyl-3-(2-methylpropoxy)-
- IUPAC
- 2-methyl-3-(2-methylpropoxy)cyclohex-2-en-1-one
- English name
- 2-Cyclohexen-1-one,2-methyl-3-(2-methylpropoxy)-(9CI)
- Molecular formula
- C11H18O2
- Molecular weight
- 182.25942
Names & synonyms
37457-15-12-Cyclohexen-1-one, 2-methyl-3-(2-methylpropoxy)-DTXSID30311878RefChem:259776DTXCID502630022-methyl-3-(2-methylpropoxy)cyclohex-2-en-1-oneNSC246159SCHEMBL4015672GIAZBUMIVSZJNX-UHFFFAOYSA-NNSC-2461593-Isobutoxy-2-methyl-2-cyclohexen-1-oneDB-281337
Show more names
2-Cyclohexen-1-one,2-methyl-3-(2-methylpropoxy)-(9CI)
3-Isobutoxy-2-methyl-2-cyclohexen-1-one #
Database identifiers
- CAS
37457-15-1- PubChem CID
- 317029
- DTXSID
DTXSID30311878- Nikkaji
- J275.643I
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 226
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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