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| CAS No.: | 6770-38-3 |
|---|---|
| Name: | 1,4-Bis(methoxymethyl)benzene |
| Article Data: | 12 |
| Molecular Structure: | |
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| Formula: | C10H14O2 |
| Molecular Weight: | 166.22 |
| Synonyms: | p-Xylene, a,a'-dimethoxy- (6CI,7CI,8CI);1,4-Bis(methoxymethyl)benzene;NSC 137830;PXDM;p-Xylylene glycol dimethylether;a,a'-Dimethoxy-1,4-xylene;a,a'-Dimethoxy-p-xylene; |
| EINECS: | 229-828-2 |
| Density: | 1.013g/cm3 |
| Melting Point: | 114-116 °C |
| Boiling Point: | 208.9 °C at 760 mmHg |
| Flash Point: | 67.1 °C |
| Solubility: | 10.642g/L at 20℃ |
| Appearance: | clear colorless liquid |
| Risk Codes: | 36/37/38 |
| Safety: | 36/37/39 |
| PSA: | 18.46000 |
| LogP: | 1.97940 |
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Specification
The Benzene,1,4-bis(methoxymethyl)-, with CAS registry number 6770-38-3, belongs to the following product category: Biphenyl & Diphenyl ether. It has the systematic name of 1,4-bis(methoxymethyl)benzene. And its classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance]. What's more, its EINECS is 229-828-2.
Physical properties of Benzene,1,4-bis(methoxymethyl)-: (1)ACD/LogP: 1.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.7; (4)ACD/LogD (pH 7.4): 1.7; (5)ACD/BCF (pH 5.5): 11.46; (6)ACD/BCF (pH 7.4): 11.46; (7)ACD/KOC (pH 5.5): 199.41; (8)ACD/KOC (pH 7.4): 199.41; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.493; (14)Molar Refractivity: 48.84 cm3; (15)Molar Volume: 167.7 cm3; (16)Polarizability: 19.36×10-24cm3; (17)Surface Tension: 32.2 dyne/cm; (18)Enthalpy of Vaporization: 42.7 kJ/mol; (19)Vapour Pressure: 0.301 mmHg at 25°C.
Preparation: this chemical can be prepared by 1,4-bis-bromomethyl-benzene and methanol. The reaction will need reagent AgO. The reaction time is 0.5 hour(s). The yield is about 91%.
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Uses of p-Chloropropiophenone: it can be used to produce 4-methoxymethyl-benzaldehyde. This reaction will need reagent DDQ and solvent CH2Cl2, H2O. The yield is about 96%.
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When you are using this chemical, please be cautious about it as the following:
The Trimesic acid irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: O(C)Cc1ccc(cc1)COC
(2)InChI: InChI=1/C10H14O2/c1-11-7-9-3-5-10(6-4-9)8-12-2/h3-6H,7-8H2,1-2H3
(3)InChIKey: DAJPMKAQEUGECW-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C10H14O2/c1-11-7-9-3-5-10(6-4-9)8-12-2/h3-6H,7-8H2,1-2H3
(5)Std. InChIKey: DAJPMKAQEUGECW-UHFFFAOYSA-N