Basic information
- CAS
57612-65-4- Standard SMILES
Cc1c(F)c(F)c(F)c(F)c1C(=O)O- InChIKey
JKNZPDHVRYPABM-UHFFFAOYSA-N- Molecular formula
- C8H4F4O2
- Average molar mass
- 208.11 g/mol
Names & identifiers
- Preferred name
- 2,3,4,5-Tetrafluoro-6-methylbenzoic acid
- IUPAC
- 2,3,4,5-tetrafluoro-6-methylbenzoic acid
Names & synonyms
2,3,4,5-tetrafluoro-6-methylbenzoic acid57612-65-4RefChem:441650978-891-9SCHEMBL2011531JKNZPDHVRYPABM-UHFFFAOYSA-N3,4,5,6-tetrafluoro-2-toluic acid6-methyl-2,3,4,5-tetrafluorobenzoic acid
Database identifiers
- CAS
57612-65-4- PubChem CID
- 12943997
- EC Number
- 978-891-9
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 235
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
11 records
Compound notes
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