Benzenemethanamine, N,N-bis(2-chloroethyl)-2-fluoro-
Basic information
- CAS
1542-45-6- Standard SMILES
Fc1ccccc1CN(CCCl)CCCl- InChIKey
OOQOTNZRNMFHBC-UHFFFAOYSA-N- Molecular formula
- C11H14Cl2FN
- Average molar mass
- 250.14 g/mol
- Monoisotopic mass
- 249.048733
Names & identifiers
- Preferred name
- Benzenemethanamine, N,N-bis(2-chloroethyl)-2-fluoro-
- IUPAC
- 2-chloro-N-(2-chloroethyl)-N-[(2-fluorophenyl)methyl]ethanamine
- English name
- N,N-Bis(2-chloroethyl)-o-fluorobenzylamine
- Molecular weight
- 0
Names & synonyms
N,N-Bis(2-chloroethyl)-o-fluorobenzylamineo-Fluoro-dcbaBRN 2645648o-Fluoro-di-(2-chloroethyl)-benzylamineN,N-Bis(2-chloroethyl)-2-fluorobenzenemethanamineBenzenemethanamine, N,N-bis(2-chloroethyl)-2-fluoro-BENZYLAMINE, N,N-BIS(2-CHLOROETHYL)-o-FLUORO-DTXSID30165555RefChem:324784DTXCID0088046Benzenemethanamine, N,N-bis(2-chloroethyl)-2-fluoro-(9CI)1542-45-6
Show more names
2-chloro-N-(2-chloroethyl)-N-[(2-fluorophenyl)methyl]ethanamineBenzenemethanamine, N,N-bis(2-chloroethyl)-2-fluoro- (9CI)benzylamine, N,N-bis(2-chloroethyl)-2-fluoro-2-Chloro-N-(2-chloroethyl)-N-[(2-fluorophenyl)methyl]ethan-1-amine
Database identifiers
- CAS
1542-45-6- PubChem CID
- 15239
- DTXSID
DTXSID30165555- Nikkaji
- J66.033G
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 163
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Related reactions
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Compound notes
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