Basic information
- CAS
23892-35-5- Standard SMILES
C[NH+](C)CC[NH+](C)C(c1ccccc1)c1ccc(Cl)cc1.O=C([O-])C(=O)O.O=C([O-])C(=O)O- InChIKey
QUXCXRXJMXKSDT-UHFFFAOYSA-N- Molecular formula
- C22H27ClN2O8
- Average molar mass
- 482.9 g/mol
- Monoisotopic mass
- 482.1455935
Names & identifiers
- Preferred name
- Ethylenediamine, N-(alpha-(p-chlorophenyl)benzyl)-N,N',N'-trimethyl-, dioxalate
- IUPAC
- [(4-chlorophenyl)-phenylmethyl]-[2-(dimethylazaniumyl)ethyl]-methylazanium;bis(2-hydroxy-2-oxoacetate)
Names & synonyms
N-(alpha-(p-Chlorophenyl)benzyl)-N,N',N'-trimethylethylenediamine dioxalateETHYLENEDIAMINE, N-(alpha-(p-CHLOROPHENYL)BENZYL)-N,N',N'-TRIMETHYL-, DIOXALATE23892-35-5RefChem:345274
Database identifiers
- CAS
23892-35-5- PubChem CID
- 32117
Properties
Computed structural properties
- Topological polar surface area
- 164 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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