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Cas Database |
| Name |
4-(Heptyloxy)cinnamic acid |
EINECS | N/A |
| CAS No. | 110683-38-0 | Density | 1.057 |
| PSA | 46.53000 | LogP | 4.13360 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C16H22 O3 | Boiling Point | 414.2±20.0 °C(Predicted) |
| Molecular Weight | 262.34400 | Flash Point | 147.9°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
4-(Heptyloxy)cinnamicacid |
Article Data | 13 |
4-(Heptyloxy)cinnamic acid Chemical Properties
Molecular Structure of 4-(Heptyloxy)cinnamic acid (CAS NO.110683-38-0):
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Systematic Name: (2E)-3-[4-(Heptyloxy)phenyl]prop-2-enoic acid
Molecular Formula: C16H22O3
Molecular Weight: 262.34
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 9
Index of Refraction: 1.542
Molar Refractivity: 78.18 cm3
Molar Volume: 248 cm3
Surface Tension: 40.9 dyne/cm
Density: 1.057 g/cm3
Flash Point: 147.9 °C
Enthalpy of Vaporization: 70.33 kJ/mol
Boiling Point: 414.2 °C at 760 mmHg
Vapour Pressure: 1.33E-07 mmHg at 25 °C
SMILES: O=C(O)\C=C\c1ccc(OCCCCCCC)cc1
InChI: InChI=1/C16H22O3/c1-2-3-4-5-6-13-19-15-10-7-14(8-11-15)9-12-16(17)18/h7-12H,2-6,13H2,1H3,(H,17,18)/b12-9+
InChIKey: PCEUYCVFQYQWJC-FMIVXFBMBR
4-(Heptyloxy)cinnamic acid Specification
4-(Heptyloxy)cinnamic acid (CAS NO.110683-38-0), its Synonyms are 2-Propenoic acid,3-[4-(heptyloxy)phenyl]- ; 3-[4-(Heptyloxy)phenyl]-2-propenoic acid .
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