Basic information
- CAS
1645-07-4- Standard SMILES
Fc1ccc(C[NH+](CCCl)CCCl)cc1.[Cl-]- InChIKey
GMPLEVVRIFGQLZ-UHFFFAOYSA-N- Molecular formula
- C11H15Cl3FN
- Average molar mass
- 286.6 g/mol
- Monoisotopic mass
- 285.025411
Names & identifiers
- Preferred name
- p-Fluoro-di-(2-chloroethyl)-benzylamine hydrochloride
- IUPAC
- bis(2-chloroethyl)-[(4-fluorophenyl)methyl]azanium chloride
Names & synonyms
p-Fluoro-di-(2-chloroethyl)-benzylamine hydrochloride1645-07-4NSC 72401N,N-Bis(2-chloroethyl)-p-fluorobenzylamine hydrochlorideBENZYLAMINE, N,N-BIS(2-CHLOROETHYL)-p-FLUORO-, HYDROCHLORIDE
Database identifiers
- CAS
1645-07-4- PubChem CID
- 15434
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 155
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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