2-Thenylamine, N,N-bis(2-bromoethyl)-, hydrobromide

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Basic information

CAS: 14742-56-4
Standard SMILES: Br.BrCCN(CCBr)Cc1cccs1
InChIKey: MVODTGURFNTEKX-UHFFFAOYSA-N
Molecular formula: C9H14Br3NS
Average molar mass: 407.99 g/mol
Monoisotopic mass: 404.83971

Names & identifiers

Preferred name: 2-Thenylamine, N,N-bis(2-bromoethyl)-, hydrobromide
IUPAC: 2-bromo-N-(2-bromoethyl)-N-(thiophen-2-ylmethyl)ethanamine;hydrobromide

Names & synonyms

DBTA2-Thenylamine, N,N-bis(2-bromoethyl)-, hydrobromide14742-56-4Di-(2-bromoethyl)-thenylamine hydrobromideN,N-Bis(2-bromoethyl)-2-thenylamine hydrobromideSCHEMBL29387177DTXSID10163716MVODTGURFNTEKX-UHFFFAOYSA-N2-Bromo-N-(2-bromoethyl)-N-[(thiophen-2-yl)methyl]ethan-1-amine--hydrogen bromide (1/1)

Database identifiers

CAS: 14742-56-4
PubChem CID: 203607
DTXSID: DTXSID10163716

Properties

Computed structural properties

Topological polar surface area: 31.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 6
Heavy atoms: 14
Formal charge: 0
Complexity: 129

Related reactions

1 records

New reaction record

HRID 1158320As reactantuspto-grants-2010_10

Compound notes

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