Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2-Isopropyl-4,5-dihydrooxazole-4-carboxylic acid |
EINECS | N/A |
CAS No. | 153180-21-3 | Density | 1.3 g/cm3 |
PSA | 58.89000 | LogP | -0.04010 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H11NO3 | Boiling Point | 277.2 °C at 760 mmHg |
Molecular Weight | 155.153 | Flash Point | 121.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-Oxazolecarboxylicacid,2-(1-methylethyl)-(9CI);2-Isopropyl-4,5-dihydrooxazole-4-carboxylic acid;2-isopropyloxazole-4-carboxylic acid |
Article Data | 2 |
The 2-Isopropyl-4,5-dihydrooxazole-4-carboxylic acid with the cas registry number of 153180-21-3 belongs to the product categories of carboxylicacid and isopropyl. This chemical's molecular formula is C7H11NO3 and formula weight is 157.168. It is also known as 4-Oxazolecarboxylic acid, 4,5-dihydro-2-(1-methylethyl)- and 2-(Propan-2-yl)-4,5-dihydro-1,3-oxazole-4-carboxylic acid. What's more, its systematic name is called 2-Isopropyl-4,5-dihydrooxazole-4-carboxylic acid.
Physical properties about this chemical are: (1)#H bond acceptors: 4; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 58.89 Å2; (5)Index of Refraction: 1.543; (6)Molar Refractivity: 38.02 cm3; (7)Molar Volume: 120.6 cm3; (8)Surface Tension: 40.8 dyne/cm; (9)Density: 1.3 g/cm3; (10)Flash Point: 121.4 °C; (11)Enthalpy of Vaporization: 56.76 kJ/mol; (12)Boiling Point: 277.2 °C at 760 mmHg; (13)Vapour Pressure: 0.00124 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)C1=NC(CO1)C(=O)O;
(2)InChI: InChI=1/C7H11NO3/c1-4(2)6-8-5(3-11-6)7(9)10/h4-5H,3H2,1-2H3,(H,9,10);
(3)InChIKey: VAJPROOEDQJSQS-UHFFFAOYA;
(4)Std. InChI: InChI=1S/C7H11NO3/c1-4(2)6-8-5(3-11-6)7(9)10/h4-5H,3H2,1-2H3,(H,9,10);
(5)Std. InChIKey: VAJPROOEDQJSQS-UHFFFAOYSA-N.