HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 217513Generated: November 4, 2026
1,3-Propanediamine, N,N-bis(2-chloroethyl)-N'-(6-methoxybenzo(b)(1,10)phenanthrolin-7-yl)-, dihydrochloride, dihydrate
https://huagongshe.com/en/chemical/217513
Identifiers & Physical Properties
| CAS No. | 38915-65-0 |
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| Molecular formula | C24H28Cl4N4O |
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| Average molar mass | 530.3 g/mol |
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| Monoisotopic mass | 528.101722 g/mol |
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| SMILES | COc1cc2cnccc2c2nc3ccccc3c(NCCCN(CCCl)CCCl)c12.Cl.Cl |
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| InChIKey | GMOACYIRCKXTGE-UHFFFAOYSA-N |
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| PubChem CID | 217513 |
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| DTXSID | DTXSID00959741 |
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Chemical & Physical Properties
| Topological polar surface area | 50.3 |
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| Hydrogen bond donors | 3 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 10 |
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| Heavy atoms | 33 |
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| Formal charge | 0 |
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| Complexity | 536 |
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