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CAS No.: | 2930-05-4 |
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Name: | BENZYL GLYCIDYL ETHER |
Article Data: | 142 |
Molecular Structure: | |
Formula: | C10H12O2 |
Molecular Weight: | 164.204 |
Synonyms: | Oxirane,[(phenylmethoxy)methyl]- (9CI);Propane, 1-(benzyloxy)-2,3-epoxy-(6CI,7CI,8CI);(Benzyloxymethyl)oxirane;Oxirane, ((phenylmethoxy)methyl)- (9CI);1-(Benzyloxy)-2,3-epoxypropane;Benzyl glycidylether;Glycidol benzyl ether;JX 011;[(Phenylmethoxy)methyl]oxirane;2-[(benzyloxy)methyl]oxirane;(+)-(Benzyloxymethyl)oxirane;2-[(Benzyloxy)methyl]oxirane;(R)-Benzyl glycidyl ether; |
EINECS: | 220-899-5 |
Density: | 1.102 g/cm3 |
Melting Point: | 89.5-90.1 °C |
Boiling Point: | 252.7 °C at 760 mmHg |
Flash Point: | 100.9 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-37/39 |
PSA: | 21.76000 |
LogP: | 1.60200 |
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The Oxirane,2-[(phenylmethoxy)methyl]-, with the CAS registry number 2930-05-4 and EINECS registry number 220-899-5, has the systematic name of 2-[(benzyloxy)methyl]oxirane. It belongs to the following product categories: Oxiranes; Simple 3-Membered Ring Compounds; Epoxides; Organic Building Blocks; Oxygen Compounds. And the molecular formula of the chemical is C10H12O2. What's more, it should be stored in the refrigerator. And it is always used as reactive diluent.
The characteristics of Oxirane,2-[(phenylmethoxy)methyl]- are as followings: (1)ACD/LogP: 2.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.04; (4)ACD/LogD (pH 7.4): 2.04; (5)ACD/BCF (pH 5.5): 20.84; (6)ACD/BCF (pH 7.4): 20.84; (7)ACD/KOC (pH 5.5): 305.98; (8)ACD/KOC (pH 7.4): 305.98; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 21.76 Å2; (13)Index of Refraction: 1.535; (14)Molar Refractivity: 46.38 cm3; (15)Molar Volume: 148.9 cm3; (16)Polarizability: 18.38×10-24cm3; (17)Surface Tension: 42.6 dyne/cm; (18)Density: 1.102 g/cm3; (19)Flash Point: 100.9 °C; (20)Enthalpy of Vaporization: 47.03 kJ/mol; (21)Boiling Point: 252.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0303 mmHg at 25°C.
Preparation of Oxirane,2-[(phenylmethoxy)methyl]-: This chemical can be prepared by phenol, epoxy chloropropane, KOH, and phenylcarbinol with violent agitationthe under the temperature of 40°C. Then after extraction and reduced pressure distillation, you can get the product. And the reaction equation is:
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 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: O(Cc1ccccc1)CC2OC2
(2)InChI: InChI=1/C10H12O2/c1-2-4-9(5-3-1)6-11-7-10-8-12-10/h1-5,10H,6-8H2
(3)InChIKey: QNYBOILAKBSWFG-UHFFFAOYAG