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| CAS No.: | 6301-02-6 |
|---|---|
| Name: | 1-AMINOHYDANTOIN |
| Article Data: | 6 |
| Molecular Structure: | |
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| Formula: | C3H5N3O2 |
| Molecular Weight: | 115.092 |
| Synonyms: | Hydantoin,1-amino- (6CI,8CI);1-Amino-2,4-imidazolidinedione;1-Aminohydantoin;NSC 44144; |
| EINECS: | 228-593-3 |
| Density: | 1.506 g/cm3 |
| Melting Point: | 195-196 °C |
| PSA: | 75.43000 |
| LogP: | -0.62110 |
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Specification
The 2,4-Imidazolidinedione,1-amino-, with the CAS registry number 6301-02-6, is also known as 1-Amino-2,4-imidazolidinedione. Its EINECS number is 228-593-3. This chemical's molecular formula is C3H5N3O2 and molecular weight is 115.09. What's more, its IUPAC name is 1-aminoimidazolidine-2,4-dione.
Physical properties of 2,4-Imidazolidinedione,1-amino- are: (1)ACD/LogP: -1.97; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.98; (4)ACD/LogD (pH 7.4): -2.34; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.98; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 43.86 Å2; (13)Index of Refraction: 1.556; (14)Molar Refractivity: 24.56 cm3; (15)Molar Volume: 76.3 cm3; (16)Polarizability: 9.73×10-24cm3; (17)Surface Tension: 62.9 dyne/cm; (18)Density: 1.506 g/cm3.
Uses of 2,4-Imidazolidinedione,1-amino-: it can be used to produce 1-[5-(4-nitro-phenyl)-furan-2-ylmethyleneamino]-imidazolidine-2,4-dione. It will need solvents H2O, dimethylformamide. The yield is about 81%.
![2,4-Imidazolidinedione,1-amino- can be used to produce 1-[5-(4-nitro-phenyl)-furan-2-ylmethyleneamino]-imidazolidine-2,4-dione](/UserFilesUpload/Uses of 2,4-Imidazolidinedione,1-amino-(1).jpg)
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1C(=O)NC(=O)N1N
(2)InChI: InChI=1S/C3H5N3O2/c4-6-1-2(7)5-3(6)8/h1,4H2,(H,5,7,8)
(3)InChIKey: KVYKDNGUEZRPGJ-UHFFFAOYSA-N