Basic information
- CAS
82894-36-8- Standard SMILES
CCCCCCOc1ccc(N(CCCl)CCCl)cc1- InChIKey
DDYJOWOZCRCCNY-UHFFFAOYSA-N- Molecular formula
- C16H25Cl2NO
- Average molar mass
- 318.3 g/mol
- Monoisotopic mass
- 317.1313198
Names & identifiers
- Preferred name
- Aniline, N,N-bis(2-chloroethyl)-p-hexyloxy-
- IUPAC
- N,N-bis(2-chloroethyl)-4-hexoxyaniline
- English name
- N,N-Bis(2-chloroethyl)-p-hexyloxyaniline
- Molecular weight
- 0
Names & synonyms
N,N-Bis(2-chloroethyl)-p-hexyloxyanilineANILINE, N,N-BIS(2-CHLOROETHYL)-p-HEXYLOXY-82894-36-8p-N,N-Bis(2-chloroethyl)aminophenol hexyl etherDTXSID80232064RefChem:319629DTXCID80154555N,N-bis(2-chloroethyl)-4-(hexyloxy)aniline
Database identifiers
- CAS
82894-36-8- PubChem CID
- 54933
- DTXSID
DTXSID80232064- Nikkaji
- J60.394E
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 215
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…