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Name |
2-Oxazolidinone,3-(1,2-propadien-1-yl)- |
EINECS | N/A |
CAS No. | 250728-91-7 | Density | 1.211 g/cm3 |
PSA | 29.54000 | LogP | 0.67510 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H7NO2 | Boiling Point | 172.709 °C at 760 mmHg |
Molecular Weight | 125.127 | Flash Point | 58.253 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3-(1,2-Propadienyl)-2-Oxazolidinone; |
Article Data | 10 |
The 2-Oxazolidinone,3-(1,2-propadien-1-yl)-, with the CAS registry number of 250728-91-7, is also known as 3-(1,2-Propadienyl)-2-Oxazolidinone. It belongs to the product category of Aminetertiary. Its molecular formula is C6H7NO2 and molecular weight is 125.1253. What's more, its systematic name is 3-Propa-1,2-dienyloxazolidin-2-one.
Physical properties about the 2-Oxazolidinone,3-(1,2-propadien-1-yl)- are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 23.448; (5)ACD/KOC (pH 7.4): 23.448; (6)#H bond acceptors: 3; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 29.54 Å2; (10)Index of Refraction: 1.583; (11)Molar Refractivity: 34.534 cm3; (12)Molar Volume: 103.337 cm3; (13)Surface Tension: 30.476 dyne/cm; (14)Density: 1.211 g/cm3; (15)Flash Point: 58.253 °C; (16)Enthalpy of Vaporization: 40.908 kJ/mol; (17)Boiling Point: 172.709 °C at 760 mmHg; (18)Vapour Pressure: 1.313 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: C=C=CN1CCOC1=O
(2) InChI: InChI=1/C6H7NO2/c1-2-3-7-4-5-9-6(7)8/h3H,1,4-5H2
(3) InChIKey: CZSZJMQGRCDCLT-UHFFFAOYAI