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5-[Bis(2-chloroethyl)amino]benzene-1,3-dicarboxylic acid
5-[bis(2-chloroethyl)amino]benzene-1,3-dicarboxylic acid
Also Known As: Stannane,thiocyanatotrimethyl|5-[bis(2-chloroethyl)amino]benzene-1,3-dicarboxylic acid
CAS: 4638-46-4
| Molecular Formula | C12H13Cl2NO4 |
|---|---|
| Molecular Weight | 305.02216 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 305.02216 |
| Monoisotopic Mass | 305.02216 |
| Heavy Atoms | 19 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 4638-46-4 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(=O)O)N(CCCl)CCCl)C(=O)O |
| InChIKey | JWRPTWZGUQMUEM-UHFFFAOYSA-N |
Product Overview
5-[Bis(2-chloroethyl)amino]benzene-1,3-dicarboxylic acid (CAS 4638-46-4), with molecular formula C12H13Cl2NO4 and molecular weight 305.02216 g/mol. IUPAC: 5-[bis(2-chloroethyl)amino]benzene-1,3-dicarboxylic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
5-[Bis(2-chloroethyl)amino]benzene-1,3-dicarboxylic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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