2-(2-Chloro-5-methylphenoxy)propanoic acid
Basic information
- CAS
30033-94-4- Standard SMILES
Cc1ccc(Cl)c(OC(C)C(=O)O)c1- InChIKey
FYAUPTBCTGCOAA-UHFFFAOYSA-N- Molecular formula
- C10H11ClO3
- Average molar mass
- 214.64 g/mol
- Monoisotopic mass
- 214.0396719
Names & identifiers
- Preferred name
- 2-(2-Chloro-5-methylphenoxy)propanoic acid
- IUPAC
- 2-(2-chloro-5-methylphenoxy)propanoic acid
- English name
- AKOS B013829
- Molecular formula
- C10H11ClO3
- Molecular weight
- 214.65
Names & synonyms
2-(2-chloro-5-methylphenoxy)propanoic acid30033-94-4DTXSID60395929RefChem:250549DTXCID50346788AKOS B013829MFCD034222112-(2-chloro-5-methyl-phenoxy)propanoic AcidSCHEMBL13973026ALBB-000821BBL016852STK436078
Show more names
CHEMBRDG-BB 3013829ART-CHEM-BB B0138292--propionsaeure2-(2-chloro-5-methyl-phenoxy)propionic acidPropanoic acid, 2-(2-chloro-5-methylphenoxy)-2-(2-chloro-5-methylphenoxy)propanoic acid(SALTDATA: FREE)
AKOS000133802AKOS016899289VS-05628CS-0216483ST50843787EN300-44867H21133F307500
Database identifiers
- CAS
30033-94-4- PubChem CID
- 3752204
- DTXSID
DTXSID60395929
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 208
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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