2-(1-Oxo-4-phenyl-2(1H)-phthalazinyl)acetohydrazide
Basic information
- CAS
126080-81-7- Standard SMILES
NNC(=O)Cn1nc(-c2ccccc2)c2ccccc2c1=O- InChIKey
YQMYAOCZQUKNRE-UHFFFAOYSA-N- Molecular formula
- C16H14N4O2
- Average molar mass
- 294.31 g/mol
- Monoisotopic mass
- 294.1116757
Names & identifiers
- Preferred name
- 2-(1-Oxo-4-phenyl-2(1H)-phthalazinyl)acetohydrazide
- IUPAC
- 2-(1-oxo-4-phenylphthalazin-2-yl)acetohydrazide
- English name
- SALOR-INT L449075-1EA
- Molecular formula
- C16H14N4O2
- Molecular weight
- 294.31
Names & synonyms
2-(1-OXO-4-PHENYL-2(1H)-PHTHALAZINYL)ACETOHYDRAZIDERefChem:451215644-909-62-(1-oxo-4-phenylphthalazin-2(1H)-yl)acetohydrazide126080-81-72-(1-oxo-4-phenylphthalazin-2-yl)acetohydrazideCBMicro_043944Cambridge id 6043713Oprea1_339589MLS001196997CHEMBL1568164DTXSID201328106
Show more names
SALOR-INT L449075-1EALurbinectedin Impurity 12
HMS2878J07AKOS001656334SMR000555622ST015288BIM-0044079.P0012-(???methyl)-4-phenyl-2-hydrophthalazin-1-one
Database identifiers
- CAS
126080-81-7- PubChem CID
- 712918
- DTXSID
DTXSID201328106- ChEMBL
CHEMBL1568164- EC Number
- 644-909-6
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 87.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 471
Experimental & physicochemical properties
Solubility33.9 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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