Poly(tetramethylene-3-methyltetramethylene ether)glycol bis(4-aminobenzoate) supplier

Name
Poly(tetramethylene-3-methyltetramethylene ether)glycol bis(4-aminobenzoate)
EINECS
CAS No. 163578-99-2
Density 1.174 g/cm³
Solubility
Melting Point
Formula C₂₃H₃₀N₂O₅
Boiling Point 594.6 °C at 760 mmHg
Molecular Weight 414.49
Flash Point 206.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-[4-(4-aminobenzoyl)oxy-3-methyl-butoxy]butyl 4-aminobenzoate;
PSA 113.87000
LogP 4.85020

Poly(tetramethylene-3-methyltetramethylene ether)glycol bis(4-aminobenzoate) Specification

The Poly(tetramethylene-3-methyltetramethylene ether)glycol bis(4-aminobenzoate), with the cas number 163578-99-2, is also called 4-[4-(4-aminobenzoyl)oxy-3-methyl-butoxy]butyl 4-aminobenzoate. Its molecular formula is C₂₃H₃₀N₂O₅.

The properties of the chemical are: (1)ACD/LogP: 4.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.31; (4)ACD/LogD (pH 7.4): 4.31; (5)#H bond acceptors: 7; (6)#H bond donors: 4; (7)#Freely Rotating Bonds: 16; (8)Polar Surface Area: 113.87 Å²; (9)Index of Refraction: 1.574; (10)Molar Refractivity: 116.6 cm³; (11)Molar Volume: 352.9 cm³; (12)Polarizability: 46.22×10^-24cm³; (13)Surface Tension: 50.1 dyne/cm; (14)Enthalpy of Vaporization: 88.63 kJ/mol; (15)Vapour Pressure: 4.15×10^-14mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(CCOCCCCOC(=O)c1ccc(cc1)N)COC(=O)c2ccc(cc2)N
(2)InChI: InChI=1/C23H30N2O5/c1-17(16-30-23(27)19-6-10-21(25)11-7-19)12-15-28-13-2-3-14-29-22(26)18-4-8-20(24)9-5-18/h4-11,17H,2-3,12-16,24-25H2,1H3
(3)InChIKey: JIWNZVALGCBGQT-UHFFFAOYAU

Product Name

Poly(tetramethylene-3-methyltetramethylene ether)glycol bis(4-aminobenzoate)

Poly(tetramethylene-3-methyltetramethylene ether)glycol bis(4-aminobenzoate) Specification

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