(2E)-3-Cyclohexylprop-2-enoic acid supplier

Name
(2E)-3-Cyclohexylprop-2-enoic acid
EINECS 604-604-1
CAS No. 56453-86-2
Article Data22
CAS DataBase
Density 1.125g/cm³
Solubility
Melting Point 58-59 °C
Formula C₉H₁₄O₂
Boiling Point 283.2°C at 760mmHg
Molecular Weight 154.209
Flash Point 189.5°C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Propenoicacid, 3-cyclohexyl-, (E)-;(E)-3-Cyclohexyl-2-propenoic acid;NSC 147133;trans-3-Cyclohexyl-2-propenoic acid;
PSA 37.30000
LogP 2.20750

(2E)-3-Cyclohexylprop-2-enoic acid Specification

The (2E)-3-Cyclohexylprop-2-enoic acid, with the CAS registry number 56453-86-2, is also known as Cyclohexaneacrylic acid,(E)-.It belongs to the product Pharmaceutical Intermediates.This chemical's molecular formula is C₉H₁₄O₂ and molecular weight is 154.20. What's more,Its systematic name is (2E)-3-Cyclohexylprop-2-enoic acid.

Physical properties about (2E)-3-Cyclohexylprop-2-enoic acid are: storage temp: (1)ACD/LogP: 2.86 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): 2.05 ; (4)ACD/LogD (pH 7.4): 0.25 ; (5)ACD/BCF (pH 5.5): 13.44; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 131.03; (8)ACD/KOC (pH 7.4): 2.09; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 26.3Å²; (13)Index of Refraction: 1.57; (14)Molar Refractivity: 44.98 cm³; (15)Molar Volume: 136.9 cm³; (16)Surface Tension: 45 dyne/cm; (17)Density: 1.125 g/cm³; (18)Flash Point: 189.5 °C; (19)Enthalpy of Vaporization: 57.46 kJ/mol; (20)Boiling Point: 283.2 °C at 760 mmHg; (21)Vapour Pressure: 0.000835 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
(1)SMILES:O=C(O)\C=C\C1CCCCC1;
(2)Std. InChI:InChI=1S/C9H14O2/c10-9(11)7-6-8-4-2-1-3-5-8/h6-8H,1-5H2,(H,10,11)/b7-6+;
(3)Std. InChIKey:GYEYFOYXHNRMGO-VOTSOKGWSA-N;

Product Name

(2E)-3-Cyclohexylprop-2-enoic acid

(2E)-3-Cyclohexylprop-2-enoic acid Specification

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