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Cas Database |
| Name |
Benzene,1,3,5-tris(azidomethyl)-2,4,6-triethyl- |
EINECS | N/A |
| CAS No. | 190779-62-5 | Density | N/A |
| PSA | 149.25000 | LogP | 4.16298 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C15H21N9 | Boiling Point | N/A |
| Molecular Weight | 327.392 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1,3,5-Tris(azidomethyl)-2,4,6-triethylbenzene; |
Article Data | 18 |
Benzene,1,3,5-tris(azidomethyl)-2,4,6-triethyl- Specification
The Benzene,1,3,5-tris(azidomethyl)-2,4,6-triethyl-, with the CAS registry number 190779-62-5, has the molecular formula C15H21N9. Besides, its molecular weight is 327.3875. Its systematic name is called 1,3,5-tris(azidomethyl)-2,4,6-triethylbenzene.
Physical properties of Benzene,1,3,5-tris(azidomethyl)-2,4,6-triethyl-: (1)ACD/LogP: 4.41; (2)ACD/LogD (pH 5.5): 6; (3)ACD/LogD (pH 7.4): 6; (4)ACD/BCF (pH 5.5): 10542; (5)ACD/BCF (pH 7.4): 10542; (6)ACD/KOC (pH 5.5): 26375; (7)ACD/KOC (pH 7.4): 26375; (8)#H bond acceptors: 9; (9)#H bond donors: 0; (10)#Freely Rotating Bonds: 9; (11)Polar Surface Area: 37.08 Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: [N-]=[N+]=N\Cc1c(c(c(c(c1CC)C\N=[N+]=[N-])CC)C\N=[N+]=[N-])CC
(2)InChI: InChI=1/C15H21N9/c1-4-10-13(7-19-22-16)11(5-2)15(9-21-24-18)12(6-3)14(10)8-20-23-17/h4-9H2,1-3H3
(3)InChIKey: LOTFAMQIFWUARY-UHFFFAOYAS
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