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178889-47-9

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Basic Information
CAS No.: 178889-47-9
Name: 1-METHYLCYCLOHEXYL ACRYLATE
Article Data: 2
Molecular Structure:
Molecular Structure of 178889-47-9 (1-METHYLCYCLOHEXYL ACRYLATE)
Formula: C10H16O2
Molecular Weight: 168.236
Synonyms: 1-Methyl-1-cyclohexylacrylate;Acrylic acid 1-methylcyclohexyl ester;
Density: 0.965 g/cm3
Boiling Point: 207.5 °C at 760 mmHg
Flash Point: 75.443 °C
PSA: 26.30000
LogP: 2.43840
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Specification

The Acrylic acid 1-methylcyclohexyl ester, its cas register number is 178889-47-9. It also can be called as 2-Propenoic acid,1-methylcyclohexyl ester and the Systematic name about this chemicals is 1-Methylcyclohexyl prop-2-enoate. It belongs to the Medical Intermediates. There are some first aid measures: (1) Inhalation, please supply fresh air. If required, provide artificial respiration, and keep patient warm, also consult doctor if symptoms persist; (2) Skin contact, please seek immediate medical advice, then instantly wash with water and soap and rinse thoroughly; (3) Eye contact, please seek immediate medical advice, and rinse opened eye for several minutes under running water. Then consult doctor; (4) Swallowing, please seek immediate medical advice.

Following are the chemical properties about Acrylic acid 1-methylcyclohexyl ester: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 26.3Å2; (5)Index of Refraction: 1.462; (6)Molar Refractivity: 47.935 cm3; (7)Molar Volume: 174.35 cm3; (8)Polarizability: 19.003x10-24cm3; (9)Surface Tension: 31.155 dyne/cm; (10)Enthalpy of Vaporization: 44.375 kJ/mol; (11)Vapour Pressure: 0.225 mmHg at 25°C

This chemical can be described computed from structure:
(1)SMILES: O=C(OC1(C)CCCCC1)C=C
(2)InChI: InChI=1/C10H16O2/c1-3-9(11)12-10(2)7-5-4-6-8-10/h3H,1,4-8H2,2H3
(3)InChIKey: CJCGDEYGAIPAEN-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C10H16O2/c1-3-9(11)12-10(2)7-5-4-6-8-10/h3H,1,4-8H2,2H3
(5)Std. InChIKey: CJCGDEYGAIPAEN-UHFFFAOYSA-N