Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2-(Benzyloxy)-5-bromobenzaldehyde |
EINECS | N/A |
CAS No. | 121124-94-5 | Density | 1.441 g/cm3 |
PSA | 26.30000 | LogP | 3.84060 |
Solubility | N/A | Melting Point |
73-74 °C |
Formula | C14H11BrO2 | Boiling Point | 405.3 °C at 760 mmHg |
Molecular Weight | 291.144 | Flash Point | 198.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
2-(Benzyloxy)-5-bromobenzenecarboxaldehyde;2-Benzyloxy-5-bromobenzaldehyde;5-Bromo-2-(benzyloxy)benzaldehyde;5-bromo-2-(phenylmethoxy)benzaldehyde;5-bromo-2-phenylmethoxybenzaldehyde; |
Article Data | 49 |
The Benzaldehyde, 5-bromo-2-(phenylmethoxy)-, with the CAS registry number 121124-94-5, has the systematic name of 2-(benzyloxy)-5-bromobenzaldehyde. It is a kind of irritant chemical, and the molecular formula of the chemical is C14H11BrO2.
The characteristics of Benzaldehyde, 5-bromo-2-(phenylmethoxy)- are as followings: (1)ACD/LogP: 4.50; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.629; (8)Molar Refractivity: 71.86 cm3; (9)Molar Volume: 201.9 cm3; (10)Polarizability: 28.48×10-24cm3; (11)Surface Tension: 47.9 dyne/cm; (12)Density: 1.441 g/cm3; (13)Flash Point: 198.9 °C; (14)Enthalpy of Vaporization: 65.69 kJ/mol; (15)Boiling Point: 405.3 °C at 760 mmHg; (16)Vapour Pressure: 8.86E-07 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Brc2cc(c(OCc1ccccc1)cc2)C=O
(2)InChI: InChI=1/C14H11BrO2/c15-13-6-7-14(12(8-13)9-16)17-10-11-4-2-1-3-5-11/h1-9H,10H2
(3)InChIKey: LXYOEDGDQBDZFK-UHFFFAOYAR