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CAS No.: | 59995-49-2 |
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Name: | 4-hydroxy-2-cyclopentenone |
Article Data: | 92 |
Molecular Structure: | |
Formula: | C5H6O2 |
Molecular Weight: | 98.1014 |
Synonyms: | 2-Cyclopenten-1-one,4-hydroxy-, (S)-;(-)-4-Hydroxy-2-cyclopentenone;(S)-4-Hydroxy-2-cyclopenten-1-one;(S)-4-Hydroxy-2-cyclopentenone;4(S)-Hydroxy-2-cyclopentenone; |
Density: | 1.299 g/cm3 |
Boiling Point: | 243.7 °C at 760 mmHg |
Flash Point: | 99.9 °C |
PSA: | 37.30000 |
LogP: | -0.12370 |
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The 2-Cyclopenten-1-one,4-hydroxy-, (4S)-, also known as 2-Cyclopenten-1-one, 4-hydroxy-, (S)-, is the organic compound with the formula C5H6O2. With the CAS registry number 59995-49-2, its systematic name is (4S)-4-hydroxycyclopent-2-en-1-one.
Physical properties of 2-Cyclopenten-1-one,4-hydroxy-, (4S)-: (1)ACD/LogP: -1.49; (2)ACD/LogD (pH 5.5): -1.49; (3)ACD/LogD (pH 7.4): -1.49; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 3.68; (7)ACD/KOC (pH 7.4): 3.68; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.559; (12)Molar Refractivity: 24.38 cm3; (13)Molar Volume: 75.4 cm3; (14)Surface Tension: 58 dyne/cm; (15)Density: 1.299 g/cm3; (16)Flash Point: 99.9 °C; (17)Enthalpy of Vaporization: 55.86 kJ/mol; (18)Boiling Point: 243.7 °C at 760 mmHg; (19)Vapour Pressure: 0.00535 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1\C=C/[C@@H](O)C1
(2)InChI: InChI=1/C5H6O2/c6-4-1-2-5(7)3-4/h1-2,4,6H,3H2/t4-/m1/s1
(3)InChIKey: DHNDDRBMUVFQIZ-SCSAIBSYBX