Basic information
- CAS
26358-63-4- Standard SMILES
COc1ccc(/C(C)=N/O)cc1- InChIKey
XXOHMWCSTKXDLH-JXMROGBWSA-N- Molecular formula
- C9H11NO2
- Average molar mass
- 165.19 g/mol
- Monoisotopic mass
- 165.07897859
Names & identifiers
- Preferred name
- N-[1-(4-methoxyphenyl)ethylidene]hydroxylamine
- IUPAC
- (NE)-N-[1-(4-methoxyphenyl)ethylidene]hydroxylamine
- English name
- Ethanone, 1-(4-methoxyphenyl)-, oxime, (1E)-
- Molecular formula
- C9H11NO2
- Molecular weight
- 165.19
Names & synonyms
4'-Methoxyacetophenone oximeN-[1-(4-methoxyphenyl)ethylidene]hydroxylamine4-Methoxyacetophenone oxime26358-63-4MFCD00029671(1E)-1-(4-Methoxyphenyl)ethanone oxime #1-(hydroxyimino)-1-(4-methoxyphenyl)ethane4'-Methoxyacetophenoneoxime(NE)-N-[1-(4-methoxyphenyl)ethylidene]hydroxylamineCHEMBL368588SCHEMBL30322657XXOHMWCSTKXDLH-JXMROGBWSA-N
Show more names
Ethanone, 1-(4-methoxyphenyl)-, oxime, (1E)-
HMS1536B08AKOS000167318FS-4532NCGC00175176-01(1E)-1-(4-Methoxyphenyl)ethanone oximeST012521(E)-1-(4-methoxyphenyl)ethan-1-one oximeCS-0248600
Database identifiers
- CAS
26358-63-4- PubChem CID
- 5397262
- ChEMBL
CHEMBL368588- EC Number
- 109-759-3
- Nikkaji
- J579.856F、J899.237A
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Melting point
- 90.7 · 90.7-91.5 °C
- Boiling point
- 288.4 · 288.4±23.0 °C(Predicted)
- Density
- 1.06 · 1.06±0.1 g/cm3(Predicted)
- pka
- 11.58 · 11.58±0.70(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Chemistry & industry
Suppliers1 total
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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