Nsc119178
Basic information
- CAS
2344-29-8- Standard SMILES
Oc1ccccc1C=Nc1cc(C(F)(F)F)ccc1Cl- InChIKey
MSGXOCFNGVTWKL-UHFFFAOYSA-N- Molecular formula
- C14H9ClF3NO
- Average molar mass
- 299.67 g/mol
- Monoisotopic mass
- 299.0324761
Names & identifiers
- Preferred name
- Nsc119178
- IUPAC
- 2-[[2-chloro-5-(trifluoromethyl)phenyl]iminomethyl]phenol
- English name
- alpha-(2-Chloro-5-(trifluoromethyl)phenylimino)-o-cresol
- Molecular formula
- C14H9ClF3NO
- Molecular weight
- 299.68
Names & synonyms
2344-29-8NSC119178ALPHA-(2-CHLORO-5-(TRIFLUOROMETHYL)PHENYLIMINO)-O-CRESOLDTXSID50425128RefChem:854808DTXCID00375962653-386-32-({[2-chloro-5-(trifluoromethyl)phenyl]imino}methyl)phenol2-[[2-chloro-5-(trifluoromethyl)phenyl]iminomethyl]phenol2-{[2-Chloro-5-(trifluoromethyl)phenyl]iminomethyl]phenolMaybridge3_000286HMS1431M22
Show more names
Phenol, 2-[[[2-chloro-5-(trifluoromethyl)phenyl]imino]methyl]-
STK672268AKOS005592729NSC-119178IDI1_0116732-[(E)-{[2-chloro-5-(trifluoromethyl)phenyl]imino}methyl]phenol(6E)-6-{[2-Chloro-5-(trifluoromethyl)anilino]methylidene}cyclohexa-2,4-dien-1-one
Database identifiers
- CAS
2344-29-8- PubChem CID
- 273754
- DTXSID
DTXSID50425128- EC Number
- 653-386-3
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
Physicochemical properties
- Melting point
- 95 · 95-96 °C
- Boiling point
- 416 · 416.0±45.0 °C(Predicted)
- Density
- 1.32 · 1.32±0.1 g/cm3(Predicted)
- pka
- 8.18 · 8.18±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 411 · H411-H302-H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
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, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 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
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H411-H302-H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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