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CAS No.: | 27975-78-6 |
---|---|
Name: | 1-PHENYL-1-PENTYN-3-OL |
Article Data: | 65 |
Molecular Structure: | |
Formula: | C11H12O |
Molecular Weight: | 160.216 |
Synonyms: | 1-Phenyl-1-pentyn-3-ol; |
Density: | 1.042 g/cm3 |
Boiling Point: | 266.909 °C at 760 mmHg |
Flash Point: | 120.468 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22 |
PSA: | 20.23000 |
LogP: | 1.80900 |
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The 1-Pentyn-3-ol, 1-phenyl-, with the CAS registry number of 27975-78-6, is also known as 1-Phenyl-1-pentyn-3-ol. It belongs to the product categories of Alkynes; Internal; Organic Building Blocks. This chemical's molecular formula is C11H12O and molecular weight is 160.21. What's more, its systematic name is called 1-Phenylpent-1-yn-3-ol. In addition, this chemical may cause damage to health. And it is harmful if swallowed.
Physical properties about 1-Pentyn-3-ol, 1-phenyl- are: (1)ACD/LogP: 2.75; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 20.23 Å2; (7)Index of Refraction: 1.556; (8)Molar Refractivity: 49.426 cm3; (9)Molar Volume: 153.757 cm3; (10)Surface Tension: 44.094 dyne/cm; (11)Density: 1.042 g/cm3; (12)Flash Point: 120.468 °C; (13)Enthalpy of Vaporization: 53.34 kJ/mol; (14)Boiling Point: 266.909 °C at 760 mmHg; (15)Vapour Pressure: 0.004 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: C(#Cc1ccccc1)C(O)CC
(2) InChI: InChI=1/C11H12O/c1-2-11(12)9-8-10-6-4-3-5-7-10/h3-7,11-12H,2H2,1H3
(3) InChIKey: QWCMSASONHVIHV-UHFFFAOYAG