N-(4-Chlorobenzylidene)-para-anisidine
Basic information
- CAS
1749-03-7- Standard SMILES
COc1ccc(N=Cc2ccc(Cl)cc2)cc1- InChIKey
LTTLSCCNSQUJKZ-UHFFFAOYSA-N- Molecular formula
- C14H12ClNO
- Average molar mass
- 245.7 g/mol
- Monoisotopic mass
- 245.0607417
Names & identifiers
- Preferred name
- N-(4-Chlorobenzylidene)-para-anisidine
- IUPAC
- 1-(4-chlorophenyl)-N-(4-methoxyphenyl)methanimine
- English name
- (4-chlorobenzylidene)-(4-methoxyphenyl)amine
- Molecular formula
- C14H12ClNO
- Molecular weight
- 245.7
Names & synonyms
N-(4-CHLOROBENZYLIDENE)-PARA-ANISIDINERefChem:827427652-148-61749-03-7N-(4-chlorobenzylidene)-4-methoxyaniline1-(4-chlorophenyl)-N-(4-methoxyphenyl)methaniminep-chlorobenzylidene-(4-methoxyphenyl)-amineBenzenamine, N-[(4-chlorophenyl)methylene]-4-methoxy-NSC139713N-(4-chlorobenzylidene)-4-methoxybenzenamineSCHEMBL2389489SCHEMBL3831434
Show more names
(4-chlorobenzylidene)-(4-methoxyphenyl)amine
DTXSID501376916STL355843AKOS000343938AKOS024333667NSC-139713DS-008059N-[(E)-(4-chlorophenyl)methylidene]-4-methoxyaniline
Database identifiers
- CAS
1749-03-7- PubChem CID
- 284100
- DTXSID
DTXSID501376916- EC Number
- 652-148-6
- Nikkaji
- J863.820I
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- Melting point
- 124 · 124-125 °C
- Boiling point
- 378.59 · 378.590±27.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.114 · 1.114±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 4.643 · 4.643±0.10(predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 411 · H411-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
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]
P264, P270, P273, P301+P317, P330, P391, 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
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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