2,4-Dichloro-6-phenoxy-1,3,5-triazine
Basic information
- CAS
4682-78-4- Standard SMILES
Clc1nc(Cl)nc(Oc2ccccc2)n1- InChIKey
ACMVCGAZNQJQFJ-UHFFFAOYSA-N- Molecular formula
- C9H5Cl2N3O
- Average molar mass
- 242.06 g/mol
- Monoisotopic mass
- 240.98096714
Overview
See also: 4,6-Dichloro-1,3,5-triazin-2-YL phenyl ether (annotation moved to).
Names & identifiers
- Preferred name
- 2,4-Dichloro-6-phenoxy-1,3,5-triazine
- IUPAC
- 2,4-dichloro-6-phenoxy-1,3,5-triazine
- English name
- 2,4-Dichloro-6-phenoxy-1,3,5-triazine
- Molecular formula
- C9H5Cl2N3O
- Molecular weight
- 242.06
Names & synonyms
2,4-dichloro-6-phenoxy-1,3,5-triazine4682-78-4MFCD004589672,6-Dichloro-4-phenoxy-1,3,5-triazine2,4-DICHLORO-6-PHENOXY-S-TRIAZINESCHEMBL1639470DTXSID202746852,4-dichloro-6-phenoxy-sym-triazineAKOS009154583AT13239PS-7566SB73258
Show more names
SALOR-INT L446602-1EA1,3,5-Triazine, 2,4-dichloro-6-phenoxy-[(4,6-Dichloro-1,3,5-triazin-2-yl)oxy]benzene
Database identifiers
- CAS
4682-78-4- PubChem CID
- 20807
- DTXSID
DTXSID20274685- Nikkaji
- J33.218F
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 192
Physicochemical properties
- Melting point
- 113 · 113-114 °C
- Boiling point
- 170 °C · 170 °C(Press: 10 Torr)
- Density
- 1.479 · 1.479±0.06 g/cm3(Predicted)
- pka
- -2.32 · -2.32±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 271 · P271-P261-P280
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2933698090 · 2933698090
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
- hs_code
- 2933698090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P271-P261-P280
Related reactions
5 records
Compound notes
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