2,4-Pentadien-1-one,1,5-diphenyl- supplier

Name
CINNAMYLIDENEACETOPHENONE
EINECS 210-385-9
CAS No. 614-57-3
Article Data54
CAS DataBase
Density 1.082 g/cm³
Solubility
Melting Point 100-102 °C
Formula C₁₇H₁₄O
Boiling Point 388.1 °C at 760 mmHg
Molecular Weight 234.298
Flash Point 169.6 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms 2,4-Pentadienophenone,5-phenyl- (6CI,7CI,8CI);1,5-Diphenyl-1,3-pentadien-5-one;1,5-Diphenyl-2,4-pentadien-1-one;Cinnamalacetophenone;Cinnamylideneacetophenone;NSC 1991;NSC 29119;NSC 406761;SP 35;5-Phenyl-2,4-pentadienophenone;
PSA 17.07000
LogP 4.13890

2,4-Pentadien-1-one,1,5-diphenyl- Specification

The 2,4-Pentadien-1-one,1,5-diphenyl-, with the CAS registry number 614-57-3, is also known as Cinnamylideneacetophenone. It belongs to the product category of Miscellaneous. Its EINECS number is 210-385-9. This chemical's molecular formula is C₁₇H₁₄O and molecular weight is 234.29. What's more, its systematic name is 1,5-diphenylpenta-2,4-dien-1-one. It is stable at common pressure and temperature, and it should be sealed and stored in a cool and dry place.

Physical properties of 2,4-Pentadien-1-one,1,5-diphenyl- are: (1)ACD/LogP: 3.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.81; (4)ACD/LogD (pH 7.4): 3.81; (5)ACD/BCF (pH 5.5): 461.15; (6)ACD/BCF (pH 7.4): 461.15; (7)ACD/KOC (pH 5.5): 2807.92; (8)ACD/KOC (pH 7.4): 2807.92; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.624; (14)Molar Refractivity: 76.43 cm³; (15)Molar Volume: 216.4 cm³; (16)Polarizability: 30.3×10^-24cm³; (17)Surface Tension: 44 dyne/cm; (18)Density: 1.082 g/cm³; (19)Flash Point: 169.6 °C; (20)Enthalpy of Vaporization: 63.72 kJ/mol; (21)Boiling Point: 388.1 °C at 760 mmHg; (22)Vapour Pressure: 3.15E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1)C=CC=Cc2ccccc2
(2)InChI: InChI=1S/C17H14O/c18-17(16-12-5-2-6-13-16)14-8-7-11-15-9-3-1-4-10-15/h1-14H
(3)InChIKey: QONKLJMPKWQQFG-UHFFFAOYSA-N

Product Name

CINNAMYLIDENEACETOPHENONE

2,4-Pentadien-1-one,1,5-diphenyl- Specification

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