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CAS No.: | 101093-37-2 |
---|---|
Name: | TRANS-4-STILBENEMETHANOL |
Article Data: | 21 |
Molecular Structure: | |
Formula: | C15H14O |
Molecular Weight: | 210.276 |
Synonyms: | Benzylalcohol, p-styryl- (6CI); |
Density: | 1.127 g/cm3 |
Melting Point: | 155-160 °C(lit.) |
Boiling Point: | 368.5 °C at 760 mmHg |
Flash Point: | 160.3 °C |
Appearance: | powder |
Hazard Symbols: | Xn |
Risk Codes: | 22-36/37/38 |
Safety: | 26 |
PSA: | 20.23000 |
LogP: | 3.34930 |
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This chemical is called trans-4-Stilbenemethanol, and its systematic name is trans-4-Stilbenemethanol. With the molecular formula of C15H14O, its molecular weight is 210.27. The CAS registry number of this chemical is 101093-37-2. In additon, this chemical is powder.
Other characteristics of the trans-4-Stilbenemethanol can be summarised as followings: (1)ACD/LogP: 3.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.65; (4)ACD/LogD (pH 7.4): 3.65; (5)ACD/BCF (pH 5.5): 349.5; (6)ACD/BCF (pH 7.4): 349.5; (7)ACD/KOC (pH 5.5): 2302.51; (8)ACD/KOC (pH 7.4): 2302.51; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.675; (14)Molar Refractivity: 70.09 cm3; (15)Molar Volume: 186.4 cm3; (16)Polarizability: 27.78×10-24cm3; (17)Surface Tension: 49.8 dyne/cm; (18)Density: 1.127 g/cm3; (19)Flash Point: 160.3 °C; (20)Enthalpy of Vaporization: 64.9 kJ/mol; (21)Boiling Point: 368.5 °C at 760 mmHg; (22)Vapour Pressure: 4.43E-06 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical is harmful if swallowed. It's irritating to eyes, respiratory system and skin. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: OCc2ccc(\C=C\c1ccccc1)cc2
2.InChI: InChI=1/C15H14O/c16-12-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-11,16H,12H2/b7-6+
3.InChIKey: ARFYUEZWYRMBSO-VOTSOKGWBD