Phenol,2,6-dimethoxy-4-(1E)-1-propen-1-yl- supplier

Name
Phenol, 2,6-dimethoxy-4-(1E)-1-propenyl-
EINECS
CAS No. 20675-95-0
Article Data18
CAS DataBase
Density 1.098 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₄O₃
Boiling Point 305.4 °C at 760 mmHg
Molecular Weight 194.23
Flash Point 138.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Phenol, 2,6-dimethoxy-4-(1E)-1-propenyl-(9CI);Phenol, 2,6-dimethoxy-4-propenyl-, (E)- (8CI);(E)-2,6-Dimethoxy-4-propenylphenol;trans-2,6-Dimethoxy-4-(1-propenyl)phenol;trans-4-Propenylsyringol;Phenol,2,6-dimethoxy-4-(1-propenyl)-, (E)-;2,6-Dimethoxy-4-[(1E)-prop-1-en-1-yl]phenol;4-((1E)Prop-1-enyl)-2,6-dimethoxyphenol;NSC 16952;
PSA 38.69000
LogP 2.44250

Phenol,2,6-dimethoxy-4-(1E)-1-propen-1-yl- Specification

The Phenol,2,6-dimethoxy-4-(1E)-1-propen-1-yl-, with the CAS registry number 20675-95-0, is also known as (E)-2,6-Dimethoxy-4-propenylphenol. This chemical's molecular formula is C₁₁H₁₄O₃ and molecular weight is 194.23. What's more, its systematic name is 2,6-Dimethoxy-4-[(1E)-prop-1-en-1-yl]phenol.

Physical properties of Phenol,2,6-dimethoxy-4-(1E)-1-propen-1-yl- are: (1)ACD/LogP: 2.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.1; (4)ACD/LogD (pH 7.4): 2.1; (5)ACD/BCF (pH 5.5): 23.07; (6)ACD/BCF (pH 7.4): 23.03; (7)ACD/KOC (pH 5.5): 329.11; (8)ACD/KOC (pH 7.4): 328.5; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 27.69 Å²; (13)Index of Refraction: 1.562; (14)Molar Refractivity: 57.38 cm³; (15)Molar Volume: 176.8 cm³; (16)Polarizability: 22.74×10^-24cm³; (17)Surface Tension: 37.8 dyne/cm; (18)Density: 1.098 g/cm³; (19)Flash Point: 138.5 °C; (20)Enthalpy of Vaporization: 56.77 kJ/mol; (21)Boiling Point: 305.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000455 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC=CC1=CC(=C(C(=C1)OC)O)OC
(2)InChI: InChI=1S/C11H14O3/c1-4-5-8-6-9(13-2)11(12)10(7-8)14-3/h4-7,12H,1-3H3/b5-4+
(3)InChIKey: YFHOHYAUMDHSBX-SNAWJCMRSA-N

Product Name

Phenol, 2,6-dimethoxy-4-(1E)-1-propenyl-

Phenol,2,6-dimethoxy-4-(1E)-1-propen-1-yl- Specification

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