Pyriclor
Basic information
- CAS
1970-40-7- Standard SMILES
O=c1c(Cl)c[nH]c(Cl)c1Cl- InChIKey
XTVIFVALDYTCLL-UHFFFAOYSA-N- Molecular formula
- C5H2Cl3NO
- Average molar mass
- 198.43 g/mol
- Monoisotopic mass
- 196.920197
Names & identifiers
- Preferred name
- Pyriclor
- IUPAC
- 2,3,5-trichloro-1H-pyridin-4-one
- English name
- 2,3,5-Trichloro-4-pyridinol
- Molecular formula
- C5H2Cl3NO
- Molecular weight
- 198.43
Names & synonyms
2,3,5-Trichloropyridin-4-ol1970-40-7PYRICLOR2,3,5-Trichloro-4-pyridinolDaxtronPyriclor [ISO]2,3,5-Trichloro-4-hydroxypyridineCaswell No. 882G4-Pyridinol, 2,3,5-trichloro-PyrichlorUNII-68ACR3FCDY68ACR3FCDY
Show more names
TRICOLOROPYRIPROPANOL2,3,5-Trichloropyridin-4-o2,3,5-trichloro-4-pyridone2,3,5-trichloro-4-pyridino2,3,5-trichloro-1H-pyridin-4-one
4-Hydroxy-2,3,5-trichloropyridineEPA Pesticide Chemical Code 482800BRN 0383795DTXSID70423541-21-00-00203 (Beilstein Handbook Reference)m 2901RefChem:177548DTXCID5022354
Database identifiers
- CAS
1970-40-7- PubChem CID
- 16076
- DTXSID
DTXSID7042354- UNII
- 68ACR3FCDY
- Nikkaji
- J7.833F
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 243
Physicochemical properties
- Melting point
- 216 °C · 216°C
- Boiling point
- 347.1 · 347.1±37.0 °C(Predicted)
- Density
- 1.579 · 1.5790 (rough estimate)
- refractive index
- 1.547 · 1.5470 (estimate)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 4.31 · 4.31±0.28(Predicted)
- Appearance
- Off-white to light yellow Solid
- Water Solubility
- 569.7 mg/L · 569.7mg/L(25 ºC)
- FDA UNII
- 68 ACR3FCDY · 68ACR3FCDY
- EPA Substance Registry System
- Pyriclor (1970-40-7)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
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
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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