Basic information
- Name:
Vanillyl ethyl ether
- CAS No.:
13184-86-6
- Molecular Structure:
- Formula:
- C10H14O3
- Molecular Weight:
- 182.22
- Synonyms:
- p-Cresol, a-ethoxy-2-methoxy- (7CI,8CI);4-(Ethoxymethyl)-2-methoxyphenol;4-Hydroxy-3-methoxybenzyl ethyl ether;Ethyl4-hydroxy-3-methoxybenzyl ether;Ethyl vanillyl ether;Phenol,4-(ethoxymethyl)-2-methoxy-;
- EINECS:
- 236-136-4
- Density:
- 1.088 g/cm3
- Boiling Point:
- 275.167 °C at 760 mmHg
- Flash Point:
- 120.217 °C
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Chemistry
Molecular Structure of Vanillyl ethyl ether (CAS NO.13184-86-6):
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IUPAC Name: 4-(Ethoxymethyl)-2-methoxyphenol
Canonical SMILES: CCOCC1=CC(=C(C=C1)O)OC
InChI: InChI=1S/C10H14O3/c1-3-13-7-8-4-5-9(11)10(6-8)12-2/h4-6,11H,3,7H2,1-2H3
InChIKey: KOCVACNWDMSLBM-UHFFFAOYSA-N
Molecular Weight: 182.21636 [g/mol]
Molecular Formula: C10H14O3
XLogP3: 0.9
H-Bond Donor: 1
H-Bond Acceptor: 3
EINECS: 236-136-4
FEMA: 3815
Index of Refraction: 1.517
Molar Refractivity: 50.74 cm3
Molar Volume: 167.5 cm3
Surface Tension: 37.6 dyne/cm
Density: 1.087 g/cm3
Flash Point: 120.2 °C
Enthalpy of Vaporization: 53.43 kJ/mol
Boiling Point: 275.2 °C at 760 mmHg
Vapour Pressure: 0.00308 mmHg at 25 °C
Specification
Vanillyl ethyl ether (CAS NO.13184-86-6), its Synonyms are Ethyl 4-hydroxy-3-methoxybenzyl ether ; Ethyl vanillyl ether ; P-Cresol, alpha-ethoxy-2-methoxy- ; Phenol, 4-(ethoxymethyl)-2-methoxy- ; alpha-Ethoxy-2-methoxy-P-cresol ; 4-(Ethoxymethyl)-2-methoxyphenol .