1,4-Dichloro-5-fluorophthalazine
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Basic information
- CAS
23928-47-4- Standard SMILES
Fc1cccc2c(Cl)nnc(Cl)c12- InChIKey
DHGXMZANOVUXAV-UHFFFAOYSA-N- Molecular formula
- C8H3Cl2FN2
- Average molar mass
- 217.02 g/mol
- Monoisotopic mass
- 215.9657317
Names & identifiers
- Preferred name
- 1,4-Dichloro-5-fluorophthalazine
- IUPAC
- 1,4-dichloro-5-fluorophthalazine
- English name
- 1,4-dichloro-5-fluorophthalazine
- Molecular formula
- C8H3Cl2FN2
- Molecular weight
- 217.03
Names & synonyms
1,4-Dichloro-5-fluorophthalazine23928-47-4MFCD160372791,4-dichloro-5-fluoro-phthalazineSCHEMBL3761582SCHEMBL3114663714-Dichloro-5-fluorophthalazineDTXSID40732393AKOS016007266DS-2565SY114351DB-328752
Show more names
PHTHALAZINE, 1,4-DICHLORO-5-FLUORO
CS-0089659
Database identifiers
- CAS
23928-47-4- PubChem CID
- 59560554
- DTXSID
DTXSID40732393
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Boiling point
- 400.3 · 400.3±40.0 °C(Predicted)
- Density
- 1.571 · 1.571±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- -1.59 · -1.59±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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