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1755-54-0

Basic Information
CAS No.: 1755-54-0
Name: 4-allyl-2-ethoxyphenol
Molecular Structure:
Molecular Structure of 1755-54-0 (4-allyl-2-ethoxyphenol)
Formula: C11H14O2
Molecular Weight: 178.231
Synonyms: Chavicol,2-ethoxy- (6CI);Phenol, 2-ethoxy-4-(2-propenyl)- (9CI);Phenol,4-allyl-2-ethoxy- (7CI,8CI);2-Ethoxy-4-allylphenol;3-Ethoxy-4-hydroxyallylbenzene;4-Allyl-2-ethoxyphenol;Ethyleugenol;2-Ethoxy-4-(prop-2-en-1-yl)phenol;
EINECS: 217-147-3
Density: 1.031 g/cm3
Boiling Point: 280.7 °C at 760 mmHg
Flash Point: 125 °C
PSA: 29.46000
LogP: 2.51940
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Specification

The Phenol,2-ethoxy-4-(2-propen-1-yl)-, with the CAS registry number 1755-54-0, is also known as 3-Ethoxy-4-hydroxyallylbenzene. This chemical's molecular formula is C11H14O2 and molecular weight is 178.23. What's more, its systematic name is 2-Ethoxy-4-(prop-2-en-1-yl)phenol and its EINECS number is 217-147-3.

Physical properties of Phenol,2-ethoxy-4-(2-propen-1-yl)- are: (1)ACD/LogP: 2.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.74; (4)ACD/LogD (pH 7.4): 2.74; (5)ACD/BCF (pH 5.5): 70.66; (6)ACD/BCF (pH 7.4): 70.6; (7)ACD/KOC (pH 5.5): 733.27; (8)ACD/KOC (pH 7.4): 732.58; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.529; (14)Molar Refractivity: 53.35 cm3; (15)Molar Volume: 172.7 cm3; (16)Polarizability: 21.15×10-24 cm3; (17)Surface Tension: 36.2 dyne/cm; (18)Density: 1.031 g/cm3; (19)Flash Point: 125 °C; (20)Enthalpy of Vaporization: 54.04 kJ/mol; (21)Boiling Point: 280.7 °C at 760 mmHg; (22)Vapour Pressure: 0.00218 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cc(ccc1O)C\C=C)CC
(2)InChI: InChI=1/C11H14O2/c1-3-5-9-6-7-10(12)11(8-9)13-4-2/h3,6-8,12H,1,4-5H2,2H3
(3)InChIKey: LEXYYUGWWDAGQB-UHFFFAOYSA-N