4,4'-Methylenebis(N-(2-hydroxy-1-naphthylmethylene)aniline)
Basic information
- CAS
4231-45-2- Standard SMILES
Oc1ccc2ccccc2c1C=Nc1ccc(Cc2ccc(N=Cc3c(O)ccc4ccccc34)cc2)cc1- InChIKey
FECLBTRXQLVKAQ-UHFFFAOYSA-N- Molecular formula
- C35H26N2O2
- Average molar mass
- 506.6 g/mol
- Monoisotopic mass
- 506.19942808
Names & identifiers
- Preferred name
- 4,4'-Methylenebis(N-(2-hydroxy-1-naphthylmethylene)aniline)
- IUPAC
- 1-[[4-[[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]methyl]phenyl]iminomethyl]naphthalen-2-ol
- English name
- 4,4'-Methylenebis(N-(2-hydroxy-1-naphthylmethylene)aniline)
- Molecular formula
- C35H26N2O2
- Molecular weight
- 506.59
Names & synonyms
4,4'-METHYLENEBIS(N-(2-HYDROXY-1-NAPHTHYLMETHYLENE)ANILINE)RefChem:506821665-405-24231-45-21,1'-(((Methylenebis(4,1-phenylene))bis(azanylylidene))bis(methanylylidene))bis(naphthalen-2-ol)1-[(E)-{[4-({4-[(E)-[(2-hydroxynaphthalen-1-yl)methylidene]amino]phenyl}methyl)phenyl]imino}methyl]naphthalen-2-olAC1NSOZMDTXSID10416693STK0771571,1'-[Methylenebis(4,1-phenylenenitrilomethylidyne)]bis[2-naphthalenol]AKOS000485696AKOS003617912
Show more names
1,1′-[Methylenebis(4,1-phenylenenitrilomethylidyne)]bis[2-naphthalenol2-Naphthalenol, 1,1'-[methylenebis(4,1-phenylenenitrilomethylidyne)]bis-
Z567655331,1'-{methylenebis[(1,4-phenylene)imino-methyl]}bis(2-naphthol)1,1'-{methanediylbis[benzene-4,1-diylnitrilo(E)methylylidene]}dinaphthalen-2-ol(1Z,1'Z)-1,1'-{Methylenebis[4,1-phenyleneazanediyl-(Z)-methanylylidene]}di(naphthalen-2(1H)-one)
Database identifiers
- CAS
4231-45-2- PubChem CID
- 2827239
- DTXSID
DTXSID10416693- EC Number
- 665-405-2
Properties
Computed structural properties
- XLogP
- 8.2
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 745
Physicochemical properties
- Melting point
- 247 · 247-248 °C
- Boiling point
- 763.7 · 763.7±60.0 °C(Predicted)
- Density
- 1.18 · 1.18±0.1 g/cm3(Predicted)
- pka
- 7.65 · 7.65±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, 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 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H413-H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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