Input interpretation
triglyme | adapalene
Chemical names and formulas
| triglyme | adapalene formula | CH_3O(CH_2CH_2O)_3CH_3 | C_28H_28O_3 Hill formula | C_8H_18O_4 | C_28H_28O_3 name | triglyme | adapalene IUPAC name | 1, 2-bis(2-methoxyethoxy)ethane | 6-[3-(1-adamantyl)-4-methoxy-phenyl]naphthalene-2-carboxylic acid alternate names | 1, 2-bis(2-methoxyethoxy)ethane | 2, 5, 8, 11-tetraoxadodecane | dimethyltriglycol | ethane, 1, 2-bis(2-methoxyethoxy)- | glyme-3 | triethylene glycol dimethyl ether | Adaferin® | Differin® mass fractions | C (carbon) 53.9% | H (hydrogen) 10.2% | O (oxygen) 35.9% | C (carbon) 81.5% | H (hydrogen) 6.84% | O (oxygen) 11.6%
Structure diagrams
| triglyme | adapalene vertex count | 12 | 31 edge count | 11 | 37 Schultz index | 1054 | 12206 Wiener index | 286 | 2664 Hosoya index | 233 | 5.03×10^6 Balaban index | 2.727 | 1.145
3D structure
3D structure
Basic properties
| triglyme | adapalene molar mass | 178.23 g/mol | 412.53 g/mol phase | liquid (at STP) | solid (at STP) melting point | -45 °C | boiling point | 216 °C | density | 0.986 g/cm^3 | 1.233 g/cm^3 solubility in water | insoluble | insoluble
Units
Hydrophobicity and permeability properties
| triglyme | adapalene experimental LogP hydrophobicity | | 8.6 predicted LogP hydrophobicity | -0.08 | 6.07 predicted LogS | -1.03 | -8.01
Liquid properties
| triglyme density | 0.986 g/cm^3 vapor pressure | 0.2 mmHg dynamic viscosity | 0.00195 Pa s surface tension | 0.02621 N/m refractive index | 1.423
Units