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2-Bromo-N-(2-chloroethyl)-N-methylethan-1-amine--hydrogen bromide (1/1)

HCID 16165
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Basic information

CAS
2003-39-6
Standard SMILES
C[NH+](CCCl)CCBr.[Br-]
InChIKey
FQOSJZMZQAPHDN-UHFFFAOYSA-N
Molecular formula
C5H12Br2ClN
Average molar mass
281.42 g/mol
Monoisotopic mass
278.9025

Names & identifiers

Preferred name
2-Bromo-N-(2-chloroethyl)-N-methylethan-1-amine--hydrogen bromide (1/1)
IUPAC
2-bromoethyl-(2-chloroethyl)-methylazanium bromide

Names & synonyms

2003-39-6DTXSID509420272-Bromo-N-(2-chloroethyl)-N-methylethan-1-amine--hydrogen bromide (1/1)RefChem:1062484DTXCID4013704462-Bromo-2'-chloro-N-methyldiethylamine hydrobromideNSC 77709DIETHYLAMINE, 2-BROMO-2'-CHLORO-N-METHYL-, HYDROBROMIDE

Database identifiers

CAS
2003-39-6
PubChem CID
16165

Properties

Computed structural properties

Topological polar surface area
4.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
9
Formal charge
0
Complexity
51.7

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