Dibenzo-30-crown-10 supplier | CasNO.17455-25-3

Name
Dibenzo-30-crown-10
EINECS
CAS No. 17455-25-3
Article Data8
CAS DataBase
Density 1.068 g/cm³
Solubility
Melting Point 106-108 °C(lit.)
Formula C₂₈H₄₀O₁₀
Boiling Point 671 °C at 760 mmHg
Molecular Weight 536.61
Flash Point 259 °C
Transport Information
Appearance white crystalline powder
Safety 37/39-26
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 5,5-Dibenzo-30-crown-10;Bis(o-phenylene)[3,4]crown-10;Dibenzo-30-C-10;Dibenzo-30-crown-10 ether;6,7,9,10,12,13,15,16,23,24,26,27,29,30,32,33-hexadecahydrodibenzo[b,q][1,4,7,10,13,16,19,22,25,28]decaoxacyclotriacontine;Dibenzo(b,q)(1,4,7,10,13,16,19,22,25,28)decaoxacyclotriacontin, 6,7,9,10,12,13,15,16,23,24,26,27,29,30,32,33-hexadecahydro-;
PSA 92.30000
LogP 3.01520

Dibenzo-30-crown-10 Specification

The Dibenzo-30-crown-10, with the CAS registry number 17455-25-3, is a kind of white crystalline powder. And it belongs to the following product categories: Crown Ethers; Functional Materials; Macrocycles for Host-Guest Chemistry. The molecular formula of the chemical is C₂₈H₄₀O₁₀.

The characteristics of Dibenzo-30-crown-10 are as followings: (1)ACD/LogP: 1.29; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 1.29; (4)ACD/LogD (pH 7.4): 1.29; (5)ACD/BCF (pH 5.5): 5.67; (6)ACD/BCF (pH 7.4): 5.67; (7)ACD/KOC (pH 5.5): 120.46; (8)ACD/KOC (pH 7.4): 120.46; (9)#H bond acceptors: 10; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 92.3 Å²; (13)Index of Refraction: 1.465; (14)Molar Refractivity: 139.02 cm³; (15)Molar Volume: 502.2 cm³; (16)Polarizability: 55.11×10^-24cm³; (17)Surface Tension: 36.3 dyne/cm; (18)Density: 1.068 g/cm³; (19)Flash Point: 259 °C; (20)Enthalpy of Vaporization: 95.03 kJ/mol; (21)Boiling Point: 671 °C at 760 mmHg; (22)Vapour Pressure: 4.08E-17 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O1c3c(OCCOCCOCCOCCOc2ccccc2OCCOCCOCCOCC1)cccc3
(2)InChI: InChI=1/C28H40O10/c1-2-6-26-25(5-1)35-21-17-31-13-9-29-11-15-33-19-23-37-27-7-3-4-8-28(27)38-24-20-34-16-12-30-10-14-32-18-22-36-26/h1-8H,9-24H2
(3)InChIKey: MXCSCGGRLMRZMF-UHFFFAOYAP

Product Name

Dibenzo-30-crown-10

Dibenzo-30-crown-10 Specification

Related Products

Hot Products