3-Ethoxy-4-phenylmethoxy-benzaldehyde supplier

Name
4-BENZYLOXY-3-ETHOXYBENZALDEHYDE
EINECS
CAS No. 60186-33-6
Article Data5
CAS DataBase
Density 1.132 g/cm³
Solubility
Melting Point 56-58°C
Formula C₁₆H₁₆O₃
Boiling Point 405.1 °C at 760 mmHg
Molecular Weight 256.301
Flash Point 190.4 °C
Transport Information
Appearance
Safety 36/37
Risk Codes 43
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Benzyloxy-3-ethoxybenzaldehyde;
PSA 35.53000
LogP 3.47680

3-Ethoxy-4-phenylmethoxy-benzaldehyde Specification

The 3-ethoxy-4-phenylmethoxy-benzaldehyde, with CAS registry number 60186-33-6, has the systematic name of 4-(benzyloxy)-3-ethoxybenzaldehyde. And the chemical formula of this chemical is C₁₆H₁₆O₃. Its molecular weight is 256.3.

Physical properties of 3-Ethoxy-4-phenylmethoxy-benzaldehyde: (1)ACD/LogP: 3.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.8; (4)ACD/LogD (pH 7.4): 3.8; (5)ACD/BCF (pH 5.5): 453.99; (6)ACD/BCF (pH 7.4): 453.99; (7)ACD/KOC (pH 5.5): 2776.63; (8)ACD/KOC (pH 7.4): 2776.63; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.581; (14)Molar Refractivity: 75.48 cm³; (15)Molar Volume: 226.3 cm³; (16)Polarizability: 29.92×10^-24cm³; (17)Surface Tension: 42.4 dyne/cm; (18)Density: 1.132 g/cm³; (19)Flash Point: 190.4 °C; (20)Enthalpy of Vaporization: 65.66 kJ/mol; (21)Boiling Point: 405.1 °C at 760 mmHg; (22)Vapour Pressure: 8.99E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2cc(OCC)c(OCc1ccccc1)cc2
(2)InChI: InChI=1/C16H16O3/c1-2-18-16-10-14(11-17)8-9-15(16)19-12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3
(3)InChIKey: NCOFQZRLIYPMNJ-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C16H16O3/c1-2-18-16-10-14(11-17)8-9-15(16)19-12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3
(5)Std. InChIKey: NCOFQZRLIYPMNJ-UHFFFAOYSA-N

Product Name

4-BENZYLOXY-3-ETHOXYBENZALDEHYDE

3-Ethoxy-4-phenylmethoxy-benzaldehyde Specification

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