Basic Information | Post buying leads | Suppliers |
Name |
Cis-2-Methylcyclopropanecarboxylic acid |
EINECS | 228-141-5 |
CAS No. | 6142-57-0 | Density | 1.171g/cm3 |
PSA | 37.30000 | LogP | 0.72700 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5H8O2 | Boiling Point | 191.2 °C at 760 mmHg |
Molecular Weight | 100.117 | Flash Point | 87.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
NSC 245493;cis-2-Methylcyclopropanecarboxylic acid; |
The Cis-2-Methylcyclopropanecarboxylic acid, with CAS registry number 6142-57-0, has the systematic name of 2-methylcyclopropanecarboxylic acid. Besides this, it is also called cyclopropanecarboxylic acid, 2-methyl-. And the chemical formula of this chemical is C5H8O2. What's more, its EINECS is 228-141-5.
Physical properties of Cis-2-Methylcyclopropanecarboxylic acid: (1)ACD/LogP: 0.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.24; (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): 22.47; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.488; (14)Molar Refractivity: 24.65 cm3; (15)Molar Volume: 85.4 cm3; (16)Polarizability: 9.77×10-24cm3; (17)Surface Tension: 42.8 dyne/cm; (18)Density: 1.171 g/cm3; (19)Flash Point: 87.8 °C; (20)Enthalpy of Vaporization: 47.11 kJ/mol; (21)Boiling Point: 191.2 °C at 760 mmHg; (22)Vapour Pressure: 0.229 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C1CC1C
(2)InChI: InChI=1/C5H8O2/c1-3-2-4(3)5(6)7/h3-4H,2H2,1H3,(H,6,7)
(3)InChIKey: AYEGPMGNMOIHDL-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C5H8O2/c1-3-2-4(3)5(6)7/h3-4H,2H2,1H3,(H,6,7)
(5)Std. InChIKey: AYEGPMGNMOIHDL-UHFFFAOYSA-N