Basic Information | Post buying leads | Suppliers |
Name |
Benzoicacid, 2-[bis(3-methoxyphenyl)methyl]- |
EINECS | N/A |
CAS No. | 6315-41-9 | Density | 1.188 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C22H20O4 | Boiling Point | 512.5 °C at 760 mmHg |
Molecular Weight | 348.39 | Flash Point | 178.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
NSC 21270;2-[Bis(3-methoxyphenyl)methyl]benzoic acid; |
The Benzoicacid, 2-[bis(3-methoxyphenyl)methyl]- has the CAS registry number 6315-41-9. This chemical's molecular formula is C22H20O4 and molecular weight is 348.39. What's more, its systematic name is 2-[Bis(3-methoxyphenyl)methyl]benzoic acid.
Physical properties of Benzoicacid, 2-[bis(3-methoxyphenyl)methyl]- are: (1)ACD/LogP: 5.20; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 44.76 Å2; (7)Index of Refraction: 1.599; (8)Molar Refractivity: 100.25 cm3; (9)Molar Volume: 293.2 cm3; (10)Polarizability: 39.74×10-24 cm3; (11)Surface Tension: 46.7 dyne/cm; (12)Density: 1.188 g/cm3; (13)Flash Point: 178.9 °C; (14)Enthalpy of Vaporization: 82.52 kJ/mol; (15)Boiling Point: 512.5 °C at 760 mmHg; (16)Vapour Pressure: 2.5E-11 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1ccccc1C(c2cc(OC)ccc2)c3cccc(OC)c3
(2)InChI: InChI=1/C22H20O4/c1-25-17-9-5-7-15(13-17)21(16-8-6-10-18(14-16)26-2)19-11-3-4-12-20(19)22(23)24/h3-14,21H,1-2H3,(H,23,24)
(3)InChIKey: FSLFYNWIPDXIFO-UHFFFAOYSA-N