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Ethylenediamine, N-(m-bromobenzyl)-N'-ethyl-N'-methyl-N-(2-pyridyl)-, maleate

HCID 6435249
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Basic information

CAS
73728-48-0
Standard SMILES
CC[NH+](C)CCN(Cc1cccc(Br)c1)c1ccccn1.O=C([O-])/C=C\C(=O)O
InChIKey
SOGKSEYYKQKGOZ-BTJKTKAUSA-N
Molecular formula
C21H26BrN3O4
Average molar mass
464.4 g/mol
Monoisotopic mass
463.11067

Names & identifiers

Preferred name
Ethylenediamine, N-(m-bromobenzyl)-N'-ethyl-N'-methyl-N-(2-pyridyl)-, maleate
IUPAC
2-[(3-bromophenyl)methyl-pyridin-2-ylamino]ethyl-ethyl-methylazanium;(Z)-4-hydroxy-4-oxobut-2-enoate

Names & synonyms

ETHYLENEDIAMINE, N-(m-BROMOBENZYL)-N'-ETHYL-N'-METHYL-N-(2-PYRIDYL)-, MALEATE73728-48-0RefChem:1085220WV 762N-m-Bromobenzyl-N'-ethyl-N'-methyl-N-2-pyridylethylenediamine maleateN-m-Brombenzyl-N-alpha-pyridyl-N'-methyl-N'-aethyl-aethylendiamin-maleinat [German]N-m-Brombenzyl-N-alpha-pyridyl-N'-methyl-N'-aethyl-aethylendiamin-maleinat

Database identifiers

CAS
73728-48-0
PubChem CID
6435249

Properties

Computed structural properties

Topological polar surface area
98 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
29
Formal charge
0
Complexity
417

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