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CAS No.: | 62668-02-4 |
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Name: | TRANS-1,3-DIPHENYL-2-PROPEN-1-OL |
Article Data: | 218 |
Molecular Structure: | |
Formula: | C15H14O |
Molecular Weight: | 210.276 |
Synonyms: | 3,3-Diphenylprop-2-en-1-ol; |
Density: | 1.11 g/cm3 |
Melting Point: | 55-57oC |
Boiling Point: | 368.471 °C at 760 mmHg |
Flash Point: | 160.31 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 20.23000 |
LogP: | 3.11060 |
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The Benzenemethanol, α-[(1E)-2-phenylethenyl]-, with the CAS registry number 62668-02-4, is also known as 3, 3-Diphenylprop-2-en-1-ol. It belongs to the product categories of Acyclic; Alkenes; Organic Building Blocks. This chemical's molecular formula is C15H14O and molecular weight is 210.27. What's more, its IUPAC name is (E)-1, 3-Diphenylprop-2-en-1-ol. In addition, it must be stored in airtight containers and placed in a dry, cool place. Meanwhile, it should be kept away from oxidant.
Physical properties about Benzenemethanol, α-[(1E)-2-phenylethenyl]- are: (1)ACD/LogP: 2.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.834; (4)ACD/LogD (pH 7.4): 2.834; (5)ACD/BCF (pH 5.5): 83.855; (6)ACD/BCF (pH 7.4): 83.855; (7)ACD/KOC (pH 5.5): 828.846; (8)ACD/KOC (pH 7.4): 828.846; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 20.23 Å2; (13)Index of Refraction: 1.639; (14)Molar Refractivity: 68.168 cm3; (15)Molar Volume: 189.365 cm3; (16)Polarizability: 27.024×10-24 cm3; (17)Surface Tension: 47.744 dyne/cm; (18)Density: 1.11 g/cm3; (19)Flash Point: 160.31 °C; (20)Enthalpy of Vaporization: 64.898 kJ/mol; (21)Boiling Point: 368.471 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: c1ccc(cc1)/C=C/C(c2ccccc2)O
(2) InChI: InChI=1/C15H14O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12,15-16H/b12-11+
(3) InChIKey: ORACYDGVNJGDMI-VAWYXSNFBY