2,2'-[1,4-Phenylenebis(methylidynenitrilo)]bis[phenol]
Basic information
- CAS
13060-68-9- Standard SMILES
Oc1ccccc1N=Cc1ccc(C=Nc2ccccc2O)cc1- InChIKey
VVMRPNQOQNNHGI-UHFFFAOYSA-N- Molecular formula
- C20H16N2O2
- Average molar mass
- 316.4 g/mol
- Monoisotopic mass
- 316.12117776
Overview
See also: N,N'-Terephthalylidenebis(2-aminophenol) (annotation moved to).
Names & identifiers
- Preferred name
- 2,2'-[1,4-Phenylenebis(methylidynenitrilo)]bis[phenol]
- IUPAC
- 2-[[4-[(2-hydroxyphenyl)iminomethyl]phenyl]methylideneamino]phenol
- English name
- 2,2'-[1,4-Phenylenebis(methylidynenitrilo)]bisphenol
- Molecular formula
- C20H16N2O2
- Molecular weight
- 316.35
Names & synonyms
2,2'-[1,4-Phenylenebis(methylidynenitrilo)]bis[phenol]2,2'-(1,4-Phenylenebis(methylidynenitrilo))bis(phenol)RefChem:44012213060-68-92,2'-(p-Phenylenedimethylidynediimino)diphenol2,2'-((1,4-Phenylenebis(methanylylidene))bis(azanylylidene))diphenolNSC 163943BRN 2815973Phenol, 2,2'-(p-phenylenebis(methylidyneimino))di-NSC1639433-13-00-00774 (Beilstein Handbook Reference)CHEMBL361904
Show more names
VVMRPNQOQNNHGI-UHFFFAOYSA-NN,N'-TEREPHTHALYLIDENEBIS(2-AMINOPHENOL)N,N'-TEREPHTHALYLIDENEBIS(2-AMINOPHENOL)2,2'-[1,4-Phenylenebis(methylidynenitrilo)]bisphenolPhenol, 2,2'-[1,4-phenylenebis(methylidynenitrilo)]bis-2-[({4-[N-(2-hydroxyphenyl)carboximidoyl]phenyl}methylidene)amino]phenol
2,2/'-[1,4-Phenylenebis(methylidynenitrilo)]bisphenolSCHEMBL14982912Phenol, 2,2'-(1,4-phenylenebis(methylidynenitrilo))bis-DTXSID5012096142-[[4-[(2-hydroxyphenyl)iminomethyl]phenyl]methylideneamino]phenolAKOS024332437NSC-163943Phenol,2'-[p-phenylenebis(methylidyneimino)]di-
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 389
Physicochemical properties
- Melting point
- 213 °C · 213 °C(Solv: ethanol (64-17-5))
- Boiling point
- 566.2 · 566.2±45.0 °C(Predicted)
- Density
- 1.15 · 1.15±0.1 g/cm3(Predicted)
- pka
- 9.02 · 9.02±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317-H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P261-P272-P280-P302+P352-P333+P313-P321-P363-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.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H317-H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…