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Cas Database |
| Name |
1,3-Bis(2-iodoethyl)urea |
EINECS | N/A |
| CAS No. | 13908-87-7 | Density | 2.25 g/cm3 |
| PSA | 41.13000 | LogP | 1.93740 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C5H10I2N2O | Boiling Point | 418 °C at 760 mmHg |
| Molecular Weight | 367.95464 | Flash Point | 206.6 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
NSC81165; |
Article Data | 2 |
1,3-Bis(2-iodoethyl)urea Specification
The 1,3-Bis(2-iodoethyl)urea, with the CAS registry number 13908-87-7, is also known as NSC81165. This chemical's molecular formula is C5H10I2N2O and molecular weight is 367.95464. Its IUPAC name is called 1,3-bis(2-iodoethyl)urea.
Physical properties of 1,3-Bis(2-iodoethyl)urea: (1)ACD/LogP: 1.64; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 4; (5)Index of Refraction: 1.632; (6)Molar Refractivity: 58.37 cm3; (7)Molar Volume: 163.4 cm3; (8)Surface Tension: 52.4 dyne/cm; (9)Density: 2.25 g/cm3; (10)Flash Point: 206.6 °C; (11)Enthalpy of Vaporization: 67.15 kJ/mol; (12)Boiling Point: 418 °C at 760 mmHg; (13)Vapour Pressure: 3.38E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C(CI)NC(=O)NCCI
(2)InChI: InChI=1S/C5H10I2N2O/c6-1-3-8-5(10)9-4-2-7/h1-4H2,(H2,8,9,10)
(3)InChIKey: JKWZNMHFINPEFO-UHFFFAOYSA-N
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