Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
1-[(1-Naphthylimino)methyl]-2-naphthol |
EINECS | N/A |
CAS No. | 29101-37-9 | Density | 1.15 g/cm3 |
PSA | 32.59000 | LogP | 5.44920 |
Solubility | N/A | Melting Point |
N/A |
Formula | C21H15NO | Boiling Point | 526.8 °C at 760 mmHg |
Molecular Weight | 297.356 | Flash Point | 353.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1-(1-Naphthyliminomethyl)naphthalen-2-ol; |
Article Data | 5 |
The CAS registry number of 1-[(1-Naphthylimino)methyl]-2-naphthol is 29101-37-9. This chemical's molecular formula is C21H15NO and molecular weight is 297.3499. What's more, both its IUPAC name and systematic name are the same which is called 1-(1-Naphthyliminomethyl)naphthalen-2-ol.
Physical properties about 1-[(1-Naphthylimino)methyl]-2-naphthol are: (1)ACD/LogP: 5.55; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.55; (4)ACD/LogD (pH 7.4): 5.5; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 32.59 Å2; (9)Index of efraction: 1.639; (10)Molar Refractivity: 93.03 cm3; (11)Molar Volume: 258.5 cm3; (12)Surface Tension: 45.4 dyne/cm; (13)Density: 1.15 g/cm3; (14)Flash Point: 353.9 °C; (15)Enthalpy of Vaporization: 83.14 kJ/mol; (16)Boiling Point: 526.8 °C at 760 mmHg; (17)Vapour Pressure: 1.03E-11 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: c1ccc2c(c1)cccc2N=Cc3c4ccccc4ccc3O
(2) InChI: InChI=1/C21H15NO/c23-21-13-12-16-7-1-3-9-17(16)19(21)14-22-20-11-5-8-15-6-2-4-10-18(15)20/h1-14,23H
(3) InChIKey: CFVMLACBKWKHEP-UHFFFAOYAR