2-Chloro-5,6-difluoro-1,3-benzothiazole
Basic information
- CAS
960535-39-1- Standard SMILES
Fc1cc2nc(Cl)sc2cc1F- InChIKey
YMEIUMKOBQLKJR-UHFFFAOYSA-N- Molecular formula
- C7H2ClF2NS
- Average molar mass
- 205.61 g/mol
- Monoisotopic mass
- 204.9564543
Names & identifiers
- Preferred name
- 2-Chloro-5,6-difluoro-1,3-benzothiazole
- IUPAC
- 2-chloro-5,6-difluoro-1,3-benzothiazole
- English name
- 2-CHLORO-5,6-DIFLUOROBENZOTHIAZOLE
- Molecular formula
- C7H2ClF2NS
- Molecular weight
- 205.61
Names & synonyms
960535-39-12-Chloro-5,6-difluoro-1,3-benzothiazoleDTXSID20856001RefChem:258848DTXCID60806742821-701-52-Chloro-5,6-difluorobenzo[d]thiazole2-chloro-5,6-difluorobenzothiazoleSCHEMBL20969676DB-330127EN300-388222G14761
Show more names
Reaxys ID: 15610009Benzothiazole, 2-chloro-5,6-difluoro-2-Chloro-5,6-difluorobenzo[d]thiazole 2-Chloro-5,6-difluorobenzo[d]thiazole
Database identifiers
- CAS
960535-39-1- PubChem CID
- 71464232
- DTXSID
DTXSID20856001- EC Number
- 821-701-5
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
- HS Code
- 29342000 · 29342000
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, 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
- 29342000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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