1-(2-Hydroxy-5-nonylphenyl)-2-phenylethanone oxime
Basic information
- CAS
52122-75-5- Standard SMILES
CCCCCCCCCc1ccc(O)c(C(Cc2ccccc2)=NO)c1- InChIKey
YCBRZJYZKWMUBG-UHFFFAOYSA-N- Molecular formula
- C23H31NO2
- Average molar mass
- 353.5 g/mol
- Monoisotopic mass
- 353.23547923
Names & identifiers
- Preferred name
- 1-(2-Hydroxy-5-nonylphenyl)-2-phenylethanone oxime
- IUPAC
- 2-(C-benzyl-N-hydroxycarbonimidoyl)-4-nonylphenol
- English name
- 1-(2-hydroxy-5-nonylphenyl)-2-phenylethan-1-one oxime
- Molecular formula
- C23H31NO2
- Molecular weight
- 353.5
Names & synonyms
52122-75-51-(2-Hydroxy-5-nonylphenyl)-2-phenylethanone oximeRefChem:2235401-(2-Hydroxy-5-nonylphenyl)-2-phenylethan-1-one oxime2-(C-benzyl-N-hydroxycarbonimidoyl)-4-nonylphenolSCHEMBL5897468YCBRZJYZKWMUBG-UHFFFAOYSA-NDTXSID701226363EINECS 257-674-62-hydroxy-5-nonyl phenyl benzyl ketoximeNS000592312-(N-Hydroxy-2-phenylethanimidoyl)-4-nonylphenol
Show more names
Ethanone, 1-(2-hydroxy-5-nonylphenyl)-2-phenyl-, oxiMe
Database identifiers
- CAS
52122-75-5- PubChem CID
- 103595
- DTXSID
DTXSID701226363- EC Number
- 257-674-6
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 52.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 390
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Related reactions
0 records
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Compound notes
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