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17343-88-3

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Basic Information
CAS No.: 17343-88-3
Name: Ethyl (E)-3-cyclohexyl-2-propenoate
Article Data: 76
Molecular Structure:
Molecular Structure of 17343-88-3 (Ethyl (E)-3-cyclohexyl-2-propenoate)
Formula: C11H18O2
Molecular Weight: 182.263
Synonyms: 2-Propenoicacid, 3-cyclohexyl-, ethyl ester, (E)-;Cyclohexaneacrylic acid, ethyl ester,(E)- (8CI);(2E)-3-Cyclohexylprop-2-enoic acid ethyl ester;(E)-Ethyl3-cyclohexylacrylate;Ethyl (E)-3-cyclohexyl-2-propenoate;Ethyl(E)-cyclohexaneacrylate;Ethyl (E)-b-cyclohexylacrylate;
Density: 1.019 g/cm3
Boiling Point: 246.4 °C at 760 mmHg
Flash Point: 113.4 °C
PSA: 26.30000
LogP: 2.68600
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Specification

This chemical is called Ethyl (E)-3-cyclohexyl-2-propenoate, and it can also be named as 2-Propenoic acid, 3-cyclohexyl-, ethyl ester, (2E)-. With the molecular formula of C11H18O2, its molecular weight is 182.26. The CAS registry number of this chemical is 17343-88-3.

Other characteristics of the Ethyl (E)-3-cyclohexyl-2-propenoate can be summarised as followings: (1)ACD/LogP: 3.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.91; (4)ACD/LogD (pH 7.4): 3.91; (5)ACD/BCF (pH 5.5): 549.02; (6)ACD/BCF (pH 7.4): 549.02; (7)ACD/KOC (pH 5.5): 3181.29; (8)ACD/KOC (pH 7.4): 3181.29; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.521; (14)Molar Refractivity: 54.45 cm3; (15)Molar Volume: 178.8 cm3; (16)Polarizability: 21.58×10-24cm3; (17)Surface Tension: 35.7 dyne/cm; (18)Density: 1.019 g/cm3; (19)Flash Point: 113.4 °C; (20)Enthalpy of Vaporization: 48.35 kJ/mol; (21)Boiling Point: 246.4 °C at 760 mmHg; (22)Vapour Pressure: 0.0272 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCC)\C=C\C1CCCCC1
2.InChI: InChI=1/C11H18O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h8-10H,2-7H2,1H3/b9-8+
3.InChIKey: SLGCKLRNFQEFEO-CMDGGOBGBO