2-(2-Acetyl-4-chlorophenoxy)propanoic acid
Basic information
- CAS
1250300-24-3- Standard SMILES
CC(=O)c1cc(Cl)ccc1OC(C)C(=O)O- InChIKey
ZDNSZYZGSDMGRM-UHFFFAOYSA-N- Molecular formula
- C11H11ClO4
- Average molar mass
- 242.65 g/mol
- Monoisotopic mass
- 242.0345865
Names & identifiers
- Preferred name
- 2-(2-Acetyl-4-chlorophenoxy)propanoic acid
- IUPAC
- 2-(2-acetyl-4-chlorophenoxy)propanoic acid
Names & synonyms
2-(2-acetyl-4-chlorophenoxy)propanoic acid1250300-24-3RefChem:453216993-369-0starbld0022638SCHEMBL15330458AAC30024AKOS011352663EN300-6474282Z927608752
Database identifiers
- CAS
1250300-24-3- PubChem CID
- 62074249
- EC Number
- 993-369-0
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 279
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
0 records
No reaction records under the current filter.
Compound notes
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