2-Thenylamine, N,N-bis(2-chloroethyl)-, hydrochloride
Basic information
- CAS
14742-53-1- Standard SMILES
Cl.ClCCN(CCCl)Cc1cccs1- InChIKey
JGMOSNLGCYXSCZ-UHFFFAOYSA-N- Molecular formula
- C9H14Cl3NS
- Average molar mass
- 274.6 g/mol
- Monoisotopic mass
- 272.991254
Names & identifiers
- Preferred name
- 2-Thenylamine, N,N-bis(2-chloroethyl)-, hydrochloride
- IUPAC
- 2-chloro-N-(2-chloroethyl)-N-(thiophen-2-ylmethyl)ethanamine;hydrochloride
Names & synonyms
2-Thenylamine, N,N-bis(2-chloroethyl)-, hydrochloride14742-53-1Di-(2-chloroethyl)-thenylamine hydrochlorideN,N-Bis(2-chloroethyl)-2-thenylamine hydrochlorideSCHEMBL29384758DTXSID90163714JGMOSNLGCYXSCZ-UHFFFAOYSA-N2-chloro-N-(2-chloroethyl)-N-(thiophen-2-ylmethyl)ethanamine;hydrochloride2-Chloro-N-(2-chloroethyl)-N-[(thiophen-2-yl)methyl]ethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
14742-53-1- PubChem CID
- 203604
- DTXSID
DTXSID90163714
Properties
Computed structural properties
- Topological polar surface area
- 31.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 129
Related reactions
10 records
Compound notes
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