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Name |
2-Cyclopentene-1-aceticacid |
EINECS | 237-146-1 |
CAS No. | 13668-61-6 | Density | 1.104g/cm3 |
PSA | 37.30000 | LogP | 1.42730 |
Solubility | N/A | Melting Point |
19 °C(lit.) |
Formula | C7H10O2 | Boiling Point | 238 °C at 760 mmHg |
Molecular Weight | 126.155 | Flash Point | 143.1 °C |
Transport Information | N/A | Appearance | colourless liquid with an unpleasant smell |
Safety | 26-37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
(2-Cyclopentenyl)aceticacid;(?à)-2-Cyclopentene-1-acetic acid;2-(Cyclopent-2-enyl)acetic acid;2-Cyclopenteneacetic acid;Cyclopent-2-en-1-ylaceticacid;Cyclopenten-3-ylacetic acid;NSC 60126; |
Article Data | 17 |
The 2-Cyclopentene-1-aceticacid, with CAS registry number 13668-61-6, belongs to the following product category: Miscellaneous. It has the systematic name of cyclopent-2-en-1-ylacetic acid. This chemical is a kind of colourless liquid with an unpleasant smell. And the chemical formula of this chemical is C7H10O2. What's more, its EINECS is 237-146-1.
Physical properties of 2-Cyclopentene-1-aceticacid: (1)ACD/LogP: 1.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.42; (4)ACD/LogD (pH 7.4): -1.39; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 14.99; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.499; (14)Molar Refractivity: 33.55 cm3; (15)Molar Volume: 114.2 cm3; (16)Polarizability: 13.3×10-24cm3; (17)Surface Tension: 46 dyne/cm; (18)Density: 1.104 g/cm3; (19)Flash Point: 143.1 °C; (20)Enthalpy of Vaporization: 52.3 kJ/mol; (21)Boiling Point: 238 °C at 760 mmHg; (22)Vapour Pressure: 0.0148 mmHg at 25°C.
Uses of 2-Cyclopentene-1-aceticacid: it can be used to produce cyclopentylacetic acid. This reaction will need reagents ethanol, platinum.
When you are using this chemical, please be cautious about it as the following:
The 2-Cyclopentene-1-aceticacid irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If 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: O=C(O)CC1\C=C/CC1
(2)InChI: InChI=1/C7H10O2/c8-7(9)5-6-3-1-2-4-6/h1,3,6H,2,4-5H2,(H,8,9)
(3)InChIKey: NNRZTJAACCRFRV-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C7H10O2/c8-7(9)5-6-3-1-2-4-6/h1,3,6H,2,4-5H2,(H,8,9)
(5)Std. InChIKey: NNRZTJAACCRFRV-UHFFFAOYSA-N