Basic information
- CAS
870062-76-3- Standard SMILES
Oc1cnc(Cl)c(F)c1- InChIKey
VEHUGRIKMHCJLQ-UHFFFAOYSA-N- Molecular formula
- C5H3ClFNO
- Average molar mass
- 147.53 g/mol
- Monoisotopic mass
- 146.98871962
Names & identifiers
- Preferred name
- 2-Chloro-3-fluoro-5-hydroxypyridine
- IUPAC
- 6-chloro-5-fluoropyridin-3-ol
- English name
- 2-Chloro-3-fluoro-5-hydroxypyridine
- Molecular formula
- C5H3ClFNO
- Molecular weight
- 147.53
Names & synonyms
2-chloro-3-fluoro-5-hydroxypyridineRefChem:468672827-887-4870062-76-36-chloro-5-fluoropyridin-3-olMFCD034115736-chloro-5-fluoro-pyridin-3-ol3-Pyridinol, 6-chloro-5-fluoro-6-chloro-5-fluoro-3-pyridinolSCHEMBL314371AMY78916-chloranyl-5-fluoranyl-pyridin-3-ol
Show more names
3-Pyridinol,6-chloro-5-fluoro-6-Chloro-5-fluoro-3-hydroxy-pyridine2-CHLORO-3-FLUORO-5-HYDROXYPYRIDINE(RS20015747)
DTXSID906541SCHEMBL29689566DTXSID90654157VEHUGRIKMHCJLQ-UHFFFAOYSA-NAKOS006282292AB14157CS-W003046AC-33400
Database identifiers
- CAS
870062-76-3- PubChem CID
- 40424737
- DTXSID
DTXSID90654157- EC Number
- 827-887-4
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 103
Physicochemical properties
- Boiling point
- 347 · 347.0±37.0 °C(Predicted)
- Density
- 1.517 · 1.517
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 7.92 · 7.92±0.10(Predicted)
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C5H3ClFNO/c6-5-4(7)1-3(9)2-8-5/h1-2,9H
- InChIKey
- VEHUGRIKMHCJLQ-UHFFFAOYSA-N
- SMILES
- C1=NC(Cl)=C(F)C=C1O
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H332-H335-H315-H319
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- 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.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H332-H335-H315-H319
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers100 total
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
Jinan Liheng Biotechnology Co., Ltd.15865262812 · [email protected]
河北松辰医药科技有限公司0319-5801333-8008 15630992918 · [email protected]
安庆百谊生物科技有限公司0556-5032306 18917961636
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
Related reactions
25 records
Compound notes
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