Basic information
- CAS
1532667-76-7- Standard SMILES
Cc1c(CCl)noc1-c1ccc(Cl)cc1- InChIKey
UIWIGHFDQBGQSA-UHFFFAOYSA-N- Molecular formula
- C11H9Cl2NO
- Average molar mass
- 242.1 g/mol
- Monoisotopic mass
- 241.0061193
Names & identifiers
- Preferred name
- 3-(Chloromethyl)-5-(4-chlorophenyl)-4-methyl-1,2-oxazole
- IUPAC
- 3-(chloromethyl)-5-(4-chlorophenyl)-4-methyl-1,2-oxazole
Names & synonyms
1532667-76-73-(Chloromethyl)-5-(4-chlorophenyl)-4-methyl-1,2-oxazoleRefChem:494632974-997-43-(Chloromethyl)-5-(4-chlorophenyl)-4-methylisoxazoleAKOS019027214EN300-5071219
Database identifiers
- CAS
1532667-76-7- PubChem CID
- 80463524
- EC Number
- 974-997-4
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 207
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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
0 records
No reaction records under the current filter.
Compound notes
Loading…