3-Methyl-5-(trichloromethyl)-1,2,4-oxadiazole
Basic information
- CAS
1195-25-1- Standard SMILES
Cc1noc(C(Cl)(Cl)Cl)n1- InChIKey
ZHFWJCUKKDMFIV-UHFFFAOYSA-N- Molecular formula
- C4H3Cl3N2O
- Average molar mass
- 201.43 g/mol
- Monoisotopic mass
- 199.931096
Names & identifiers
- Preferred name
- 3-Methyl-5-(trichloromethyl)-1,2,4-oxadiazole
- IUPAC
- 3-methyl-5-(trichloromethyl)-1,2,4-oxadiazole
- English name
- 4-Chloro-3-fluoro-2-Methylpyridine
- Molecular formula
- C4H3Cl3N2O
- Molecular weight
- 201.44
Names & synonyms
3-Methyl-5-(trichloromethyl)-1,2,4-oxadiazole1,2,4-Oxadiazole, 3-methyl-5-(trichloromethyl)-UNII-L7644EE165L7644EE165DTXSID9073254RefChem:94790DTXCID9033507825-544-31195-25-1MFCD019382993-Methyl-5-trichloromethyl-1,2,4-oxadiazoleC4H3Cl3N2O
Show more names
SCHEMBL1453473-Methyl-5-(trichloromethyl)SCHEMBL27343664ZHFWJCUKKDMFIV-UHFFFAOYSA-NBAA19525AKOS022182871CS-12359SY047555
Database identifiers
- CAS
1195-25-1- PubChem CID
- 70953
- DTXSID
DTXSID9073254- UNII
- L7644EE165
- EC Number
- 825-544-3
- Nikkaji
- J1.552.261E
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 126
Physicochemical properties
- FDA UNII
- 7644 EE165 · L7644EE165
- EPA Substance Registry System
- 1 · 1,2,4-Oxadiazole, 3-methyl-5-(trichloromethyl)- (1195-25-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
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
H227 (50%): Combustible liquid [Warning Flammable liquids]
P210, 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, P370+P378, P403, 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 CategoriesFlam. Liq. 4 (50%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P261-P280-P305+P351+P338
Related reactions
7 records
Compound notes
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