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| CAS No.: | 1848-69-7 |
|---|---|
| Name: | 1-PHENYL-IMIDAZOLIDIN-2-ONE |
| Article Data: | 27 |
| Molecular Structure: | |
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|
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| Formula: | C9H10N2O |
| Molecular Weight: | 162.191 |
| Synonyms: | 1-Phenyl-2-imidazolidinone;3-Phenyl-2-imidazolidinone;NSC 80633; |
| Density: | 1.188 g/cm3 |
| Melting Point: | 68 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | Xi:; ">  Xi:; |
| Safety: | 24/25 |
| PSA: | 32.34000 |
| LogP: | 1.61000 |
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- Total:18 Page 1 of 1 1
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Specification
The 2-Imidazolidinone,1-phenyl-, with the CAS registry number 1848-69-7, is also known as 1-Phenyl-2-imidazolidinone. It belongs to the product categorie of Classes of pharmacetical. This chemical's molecular formula is C9H10N2O and molecular weight is 162.19. What's more, its IUPAC name is 1-phenylimidazolidin-2-one. When you are using this chemical, please be cautious about it. It may cause inflammation to the skin or other mucous membranes.
Physical properties of 2-Imidazolidinone,1-phenyl- are: (1)ACD/LogP: 0.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.49; (4)ACD/LogD (pH 7.4): 0.49; (5)ACD/BCF (pH 5.5): 1.39; (6)ACD/BCF (pH 7.4): 1.39; (7)ACD/KOC (pH 5.5): 43.97; (8)ACD/KOC (pH 7.4): 43.97; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 23.55Å2; (13)Index of Refraction: 1.578; (14)Molar Refractivity: 45.32 cm3; (15)Molar Volume: 136.4 cm3; (16)Polarizability: 17.96×10-24cm3; (17)Surface Tension: 45.2 dyne/cm; (18)Density: 1.188 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C2NCCN2c1ccccc1
(2)Std. InChI: InChI=1S/C9H10N2O/c12-9-10-6-7-11(9)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,12)
(3)Std. InChIKey: QKKGTRSHKSWYAK-UHFFFAOYSA-N