2-Oxazolidinone,3-(1,2-propadien-1-yl)- supplier

Name
2-Oxazolidinone,3-(1,2-propadienyl)-(9CI)
EINECS
CAS No. 250728-91-7
Article Data10
CAS DataBase
Density 1.211 g/cm³
Solubility
Melting Point
Formula C₆H₇NO₂
Boiling Point 172.709 °C at 760 mmHg
Molecular Weight 125.127
Flash Point 58.253 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-(1,2-Propadienyl)-2-Oxazolidinone;
PSA 29.54000
LogP 0.67510

2-Oxazolidinone,3-(1,2-propadien-1-yl)- Specification

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

Product Name

2-Oxazolidinone,3-(1,2-propadienyl)-(9CI)

2-Oxazolidinone,3-(1,2-propadien-1-yl)- Specification

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