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| Name |
Isometamidium chloride |
EINECS | 251-926-9 |
| CAS No. | 34301-55-8 | Density | 1.208?g/mL?at 25?°C(lit.) |
| PSA | 116.52000 | LogP | 4.40270 |
| Solubility | N/A | Melting Point |
approximate 245℃ (dec.) |
| Formula | C28H26ClN7 | Boiling Point | 103?°C10?mm Hg(lit.) |
| Molecular Weight | 496.01 | Flash Point | 220?°F |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Phenanthridinium,3-amino-8-[3-[3-(aminoiminomethyl)phenyl]-1-triazenyl]-5-ethyl-6-phenyl-,chloride (9CI);Phenanthridinium,8-[3-(m-amidinophenyl)-2-triazeno]-3-amino-5-ethyl-6-phenyl-, chloride (8CI);Isometamidium chloride;B 4180A;M and B 4180A;3-[2-(3-Amino-5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide chloride; |
Isometamidium chloride Specification
The CAS register number of Isometamidium chloride is 34301-55-8. It also can be called as Phenanthridinium,3-amino-8-[3-[3-(aminoiminomethyl)phenyl]-2-triazen-1-yl]-5-ethyl-6-phenyl-,chloride (1:1) and the IUPAC name about this chemical is 3-[2-(3-amino-5-ethyl-6-phenylphenanthridin-5-ium-8-yl)iminohydrazinyl]benzenecarboximidamide chloride. The molecular formula about this chemical is C28H26ClN7 and molecular weight is 496.01. This chemcial is a trypanocidal agent used in veterinary medicine.
Physical properties about Isometamidium chloride are: (1)#H bond acceptors: 7; (2)#H bond donors: 6; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 50.68Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].[N@H]=C(N)c1cc(ccc1)N/N=N/c4ccc3c2ccc(N)cc2[n+](c(c3c4)c5ccccc5)CC
(2)InChI: InChI=1/C28H25N7.ClH/c1-2-35-26-16-20(29)11-13-24(26)23-14-12-22(17-25(23)27(35)18-7-4-3-5-8-18)33-34-32-21-10-6-9-19(15-21)28(30)31;/h3-17,29H,2H2,1H3,(H4,30,31,32,33);1H
(3)InChIKey: QNZJTSGALAVCLH-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C28H25N7.ClH/c1-2-35-26-16-20(29)11-13-24(26)23-14-12-22(17-25(23)27(35)18-7-4-3-5-8-18)33-34-32-21-10-6-9-19(15-21)28(30)31;/h3-17,29H,2H2,1H3,(H4,30,31,32,33);1H
(5)Std. InChIKey: QNZJTSGALAVCLH-UHFFFAOYSA-N
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