p-Iodo-di-(2-chloroethyl)-benzylamine hydrochloride

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Basic information

CAS: 25022-84-8
Standard SMILES: ClCC[NH+](CCCl)Cc1ccc(I)cc1.[Cl-]
InChIKey: UHSRTJXRMRGAQW-UHFFFAOYSA-N
Molecular formula: C11H15Cl3IN
Average molar mass: 394.5 g/mol
Monoisotopic mass: 392.93148

Names & identifiers

Preferred name: p-Iodo-di-(2-chloroethyl)-benzylamine hydrochloride
IUPAC: bis(2-chloroethyl)-[(4-iodophenyl)methyl]azanium chloride

Names & synonyms

p-Iodo-di-(2-chloroethyl)-benzylamine hydrochloride25022-84-8N,N-Bis(2-chloroethyl)-p-iodobenzylamine hydrochlorideBENZYLAMINE, N,N-BIS(2-CHLOROETHYL)-p-IODO-, HYDROCHLORIDE

Database identifiers

CAS: 25022-84-8
PubChem CID: 32766

Properties

Computed structural properties

Topological polar surface area: 4.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 6
Heavy atoms: 16
Formal charge: 0
Complexity: 155

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Compound notes

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