Basic information
- CAS
109919-33-7- Standard SMILES
O=c1[nH]cc(Cl)c(C(F)(F)F)c1Cl- InChIKey
FJMCMQWRXXMLHT-UHFFFAOYSA-N- Molecular formula
- C6H2Cl2F3NO
- Average molar mass
- 231.98 g/mol
- Monoisotopic mass
- 230.9465536
Names & identifiers
- Preferred name
- 3,5-Dichloro-4-(trifluoromethyl)pyridin-2-ol
- IUPAC
- 3,5-dichloro-4-(trifluoromethyl)-1H-pyridin-2-one
- English name
- 3,5-Dichloro-4-trifluoromethyl-pyridin-2-ol
- Molecular formula
- C6H2Cl2F3NO
- Molecular weight
- 231.99
Names & synonyms
109919-33-73,5-dichloro-4-(trifluoromethyl)pyridin-2-ol3,5-DICHLORO-4-TRIFLUOROMETHYL-PYRIDIN-2-OL2-Hydroxy-3,5-dichloro-4-trifluoromethylpyridine3,5-dichloro-4-(trifluoromethyl)-1H-pyridin-2-oneMFCD11227182SCHEMBL10679161FJMCMQWRXXMLHT-UHFFFAOYSA-NSBB097840AS-5801CS-03296433,5-Dichloro-4-(trifluoromethyl)-2-pyridinol
Show more names
2(1H)-Pyridinone, 3,5-dichloro-4-(trifluoromethyl)-
F316674
Database identifiers
- CAS
109919-33-7- PubChem CID
- 13851616
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 318
Physicochemical properties
- Boiling point
- 215.5 · 215.5±40.0 °C(Predicted)
- Density
- 1.65 · 1.65±0.1 g/cm3(Predicted)
- pka
- 7.22 · 7.22±0.10(Predicted)
- 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
Chemistry & industry
Suppliers3 total
南京麦瑞米生物技术有限公司025-87782433 18021532344 · [email protected]
Coresyn Pharmatech Co., Ltd.+86-571-86626709 +86-18157142896 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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