Phenyl 2-pyridyl ketone oxime
Basic information
- CAS
1826-28-4- Standard SMILES
ON=C(c1ccccc1)c1ccccn1- InChIKey
RSJDEVMJZLLAHS-UHFFFAOYSA-N- Molecular formula
- C12H10N2O
- Average molar mass
- 198.22 g/mol
- Monoisotopic mass
- 198.07931295
Overview
forms stable and relatively insoluble complexes with several transition metals
Names & identifiers
- Preferred name
- Phenyl 2-pyridyl ketone oxime
- IUPAC
- N-[phenyl(pyridin-2-yl)methylidene]hydroxylamine
- English name
- Phenyl 2-pyridyl ketoxime
- Molecular formula
- C12H10N2O
- Molecular weight
- 198.22
Names & synonyms
Phenyl 2-pyridyl ketone oximePPKO oximeRefChem:861550217-374-81826-28-4N-[PHENYL(PYRIDIN-2-YL)METHYLIDENE]HYDROXYLAMINEPhenyl(pyridin-2-yl)methanone oximeMFCD00006310PPKOphenyl(2-pyridyl)methanone oximesyn-PHENYL-2-PYRIDYLKETOXIME2-benzoylpyridine oxime
Show more names
PPKO【Dotite】TIMTEC-BB SBB008988Phenyl(pyridin-2-yl)PhenylpyridylketoximePHENYL-A-PYRIDYL KETOXIMEPHENYL 2-PYRIDYL KETOXIME2-Benzoylpyridiineketoxime2-BENZOYLPYRIDINE KETOXIME
ChemDiv3_000365Oprea1_646511(E)-N-[PHENYL(PYRIDIN-2-YL)METHYLIDENE]HYDROXYLAMINESCHEMBL322444SCHEMBL29498791RSJDEVMJZLLAHS-UHFFFAOYSA-NWBSIGZZXFQOEJK-QXMHVHEDSA-NWBSIGZZXFQOEJK-VAWYXSNFSA-N
Database identifiers
- CAS
1826-28-4- PubChem CID
- 74582
- DTXSID
DTXSID5062003- EC Number
- 217-374-8
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 45.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 222
Physicochemical properties
- Melting point
- 154 · 154-156 °C (lit.)
- storage temp.
- 30 °C · Store below +30°C.
- form
- Crystalline Powder
- color
- Slightly pink
- Water Solubility
- insoluble
- InChI
- 1S/C12H10N2O/c15-14-12(10-6-2-1-3-7-10)11-8-4-5-9-13-11/h1-9,15H/b14-12+
- InChIKey
- RSJDEVMJZLLAHS-WYMLVPIESA-N
- SMILES
- O\N=C(/c1ccccc1)c2ccccn2
- CAS DataBase Reference
- 1826 · 1826-28-4(CAS DataBase Reference)
- NIST Chemistry Reference
- Phenyl-«alpha»-pyridyl ketoxime(1826-28-4)
- EPA Substance Registry System
- -2 · Methanone, phenyl-2-pyridinyl-, oxime (1826-28-4)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
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
Danger
H301 (97.5%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (97.5%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2811 6.1/PG 3
- hs_code
- 29333990
- risk_code
- 25-37/38-41-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- hazard_code
- T,Xi
- safety_code
- 26-36/37/39-45-37/39
- hazard_class
- 6.1
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- target organs
- Respiratory system
- Hazard statements
- H301-H315-H318-H335
Chemistry & industry
Applications
UsesPhenyl 2-pyridyl ketoxime was used in preparation of inverse-9-metallacrown-3, trinuclear clusters.
General DescriptionThe complexation reaction of phenyl 2-pyridyl ketoxime with some transition and heavy metal ions Co2+, Ni2+, Zn2+, Pb2+, Fe2+, Fe3+, Cr3+ and La2+ has been studied potentiometrically. The reactions of phenyl(2-pyridyl)ketone oxime, with nickel(II) sulfate hexahydrate, in the absence of an external base, have been investigated.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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