(4-Ethylphenoxy)acetic acid
Basic information
- CAS
24431-27-4- Standard SMILES
CCc1ccc(OCC(=O)O)cc1- InChIKey
WVELHLIHMYYZAT-UHFFFAOYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- (4-Ethylphenoxy)acetic acid
- IUPAC
- 2-(4-ethylphenoxy)acetic acid
- English name
- 4-Ethylphenoxyacetic acid
- Molecular formula
- C10H12O3
- Molecular weight
- 180.2
Names & synonyms
(4-Ethylphenoxy)acetic acid2-(4-ethylphenoxy)acetic acid24431-27-4HEV5GUH92XEINECS 246-245-9DTXSID70179191RefChem:402784DTXCID00101682246-245-94-ethylphenoxyacetic acidMFCD00014366Acetic acid, (4-ethylphenoxy)-
Show more names
AURORA 924AKOS B013812AKOS BB/0024AKOS BBS-000076022-(4-ethylphenoxy)ethanoic acidAcetic acid, 2-(4-ethylphenoxy)-
UNII-HEV5GUH92X(p-ethylphenoxy)acetic acidCambridge id 5147400SCHEMBL2336059SCHEMBL10399496ALBB-000226BBL015073SBB004547
Database identifiers
- CAS
24431-27-4- PubChem CID
- 90499
- DTXSID
DTXSID70179191- UNII
- HEV5GUH92X
- EC Number
- 246-245-9
- Nikkaji
- J287.247A
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Melting point
- 92 · 92-94°C
- BRN
- 2259506 · 2259506
- CAS DataBase Reference
- 24431 · 24431-27-4
- FDA UNII
- 5 GUH92X · HEV5GUH92X
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- 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.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Suppliers
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Related reactions
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Compound notes
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