Basic information
- CAS
1565634-54-9- Standard SMILES
N#Cc1nc(F)ccc1Br- InChIKey
CDOGLNDZTGQNPR-UHFFFAOYSA-N- Molecular formula
- C6H2BrFN2
- Average molar mass
- 201 g/mol
- Monoisotopic mass
- 199.93854
Names & identifiers
- Preferred name
- 3-Bromo-6-fluoropyridine-2-carbonitrile
- IUPAC
- 3-bromo-6-fluoropyridine-2-carbonitrile
- English name
- 3-bromo-6-fluoropyridine-2-carbonitrile
- Molecular formula
- C6H2BrFN2
- Molecular weight
- 201
Names & synonyms
1565634-54-93-bromo-6-fluoropyridine-2-carbonitrileRefChem:499076889-582-23-Bromo-6-fluoropicolinonitrile3-Bromo-6-fluoro-pyridine-2-carbonitrileMFCD26904956G79307EN300-3263590Z16652517473-Bromo-6-fluoro-2-pyridinecarbonitrile2-Pyridinecarbonitrile, 3-bromo-6-fluoro-
Database identifiers
- CAS
1565634-54-9- PubChem CID
- 84669802
- EC Number
- 889-582-2
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 164
Physicochemical properties
- Boiling point
- 291.7 · 291.7±40.0 °C(Predicted)
- Density
- 1.81 · 1.81±0.1 g/cm3(Predicted)
- pka
- -8.34 · -8.34±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H302-H332-H335-H312-H319
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P
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 1 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H302-H332-H335-H312-H319
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P312-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers10 total
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
南京药石科技股份有限公司025-86918202 4000255188 · [email protected]
苏州亚衍医药科技有限公司17715136450 · [email protected]
宁波苯康基石医药科技有限公司15990591583
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]
誉通医药科技（苏州）有限公司0512-15851462628 15851462628 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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