Ethyl 2-hydroxycyclohexanecarboxylate supplier

Name
ETHYL 2-HYDROXYCYCLOHEXANECARBOXYLATE
EINECS
CAS No. 3444-72-2
Article Data24
CAS DataBase
Density 1.093 g/cm³
Solubility
Melting Point
Formula C₉H₁₆O₃
Boiling Point 251.4 °C at 760 mmHg
Molecular Weight 172.224
Flash Point 100.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Carbethoxycyclohexanol;Ethyl 2-hydroxycyclohexanecarboxylate;NSC 245145;
PSA 46.53000
LogP 1.10060

Ethyl 2-hydroxycyclohexanecarboxylate Specification

The CAS registry number of Cyclohexanecarboxylicacid,2-hydroxy-,ethyl ester is 3444-72-2. The IUPAC name is ethyl 2-hydroxycyclohexanecarboxylate. In addition, the molecular formula is C₉H₁₆O₃ and the molecular weight is 172.22. It belongs to the class of Pharmacetical.

Physical properties about Cyclohexanecarboxylicacid,2-hydroxy-,ethyl ester are: (1)ACD/LogP: 1.20; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 35.53 Å²; (7)Index of Refraction: 1.481; (8)Molar Refractivity: 44.84 cm³; (9)Molar Volume: 157.5 cm³; (10)Polarizability: 17.77 ×10^-24cm³; (11)Surface Tension: 41.2 dyne/cm; (12)Density: 1.093 g/cm³; (13)Flash Point: 100.2 °C; (14)Enthalpy of Vaporization: 56.78 kJ/mol; (15)Boiling Point: 251.4 °C at 760 mmHg; (16)Vapour Pressure: 0.00322 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)C1CCCCC1O
(2)InChI: InChI=1/C9H16O3/c1-2-12-9(11)7-5-3-4-6-8(7)10/h7-8,10H,2-6H2,1H3
(3)InChIKey: WOGRTPJVNNCUKN-UHFFFAOYAN

Product Name

ETHYL 2-HYDROXYCYCLOHEXANECARBOXYLATE

Ethyl 2-hydroxycyclohexanecarboxylate Specification

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