Product Name

  • Name

    CARVACRYL ETHYL ETHER

  • EINECS 225-238-4
  • CAS No. 4732-13-2
  • Article Data13
  • CAS DataBase
  • Density 0.908 g/cm3
  • Solubility Slightly soluble in water, miscible in oils
  • Melting Point
  • Formula C12H18O
  • Boiling Point 237.6 °C at 760 mmHg
  • Molecular Weight 178.274
  • Flash Point 82 °C
  • Transport Information
  • Appearance Colorless to pale yellow liquid
  • Safety 26-36
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 4732-13-2 (CARVACRYL ETHYL ETHER)
  • Hazard Symbols IrritantXi
  • Synonyms Phenetole,5-isopropyl-2-methyl- (6CI,7CI,8CI);Carvacrol ethyl ether;Carvacryl ethylether;Ethylcarvacrol;
  • PSA 9.23000
  • LogP 3.51710

Carvacryl ethyl ether Specification

The Carvacryl ethyl ether, with the CAS registry number 4732-13-2 and EINECS registry number 225-238-4, has the systematic name of 2-ethoxy-1-methyl-4-(propan-2-yl)benzene. It belongs to the following product categories: Alphabetical Listings; C-D; Flavors and Fragrances. And the molecular formula of the chemical is C12H18O.

The characteristics of Carvacryl ethyl ether are as followings: (1)ACD/LogP: 4.46; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.46; (4)ACD/LogD (pH 7.4): 4.46; (5)ACD/BCF (pH 5.5): 1454; (6)ACD/BCF (pH 7.4): 1454; (7)ACD/KOC (pH 5.5): 6387.95; (8)ACD/KOC (pH 7.4): 6387.95; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.488; (14)Molar Refractivity: 56.57 cm3; (15)Molar Volume: 196.2 cm3; (16)Polarizability: 22.42×10-24cm3; (17)Surface Tension: 29.2 dyne/cm; (18)Density: 0.908 g/cm3; (19)Flash Point: 82 °C; (20)Enthalpy of Vaporization: 45.52 kJ/mol; (21)Boiling Point: 237.6 °C at 760 mmHg; (22)Vapour Pressure: 0.0683 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O(c1cc(ccc1C)C(C)C)CC
(2)InChI: InChI=1/C12H18O/c1-5-13-12-8-11(9(2)3)7-6-10(12)4/h6-9H,5H2,1-4H3
(3)InChIKey: DOTAGKFIHPPPTK-UHFFFAOYAF

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