5-Chloro-2-(P-tolyloxy)-aniline
Basic information
- CAS
16824-48-9- Standard SMILES
Cc1ccc(Oc2ccc(Cl)cc2N)cc1- InChIKey
OHGYKIYLSCVORI-UHFFFAOYSA-N- Molecular formula
- C13H12ClNO
- Average molar mass
- 233.69 g/mol
- Monoisotopic mass
- 233.0607417
Names & identifiers
- Preferred name
- 5-Chloro-2-(P-tolyloxy)-aniline
- IUPAC
- 5-chloro-2-(4-methylphenoxy)aniline
- English name
- 5-Chloro-2-(4-methylphenoxy)aniline hydrochloride
- Molecular formula
- C13H12ClNO
- Molecular weight
- 233.69
Names & synonyms
5-CHLORO-2-(P-TOLYLOXY)-ANILINERefChem:534480653-008-75-chloro-2-(4-methylphenoxy)aniline5-Chloro-2-(p-tolyloxy)anilineBenzenamine, 5-chloro-2-(4-methylphenoxy)-MLS001018214CHEMBL1321829HMS2650K23AKOS000101696SMR000354454EN300-40588
Show more names
5-Chloro-2-(4-methylphenoxy)benzenamine5-Chloro-2-(p-tolyloxy)aniline hydrochloride
Z56943505
Database identifiers
- CAS
16824-48-9- PubChem CID
- 855072
- ChEMBL
CHEMBL1321829- EC Number
- 653-008-7
- Nikkaji
- J307.685G
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 216
Physicochemical properties
- Boiling point
- 338.7 · 338.7±32.0 °C(Predicted)
- Density
- 1.226 · 1.226±0.06 g/cm3(Predicted)
- pka
- 3.4 · 3.40±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09,GHS05
- Signal word
- Danger
- Hazard statements
- 302 · H302-H315-H335-H317-H410-H318
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
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, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS09,GHS05
- Hazard statements
- H302-H315-H335-H317-H410-H318
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Suppliers
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Related reactions
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Compound notes
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