4-(4-aminophenoxy)-N,N-bis(2-chloroethyl)aniline
Basic information
- CAS
92961-98-3- Standard SMILES
Nc1ccc(Oc2ccc(N(CCCl)CCCl)cc2)cc1- InChIKey
OQGBHXDFUZBWSS-UHFFFAOYSA-N- Molecular formula
- C16H18Cl2N2O
- Average molar mass
- 325.2 g/mol
- Monoisotopic mass
- 324.0796186
Names & identifiers
- Preferred name
- 4-(4-aminophenoxy)-N,N-bis(2-chloroethyl)aniline
- IUPAC
- 4-[4-[bis(2-chloroethyl)amino]phenoxy]aniline
Names & synonyms
92961-98-34-(4-aminophenoxy)-N,N-bis(2-chloroethyl)anilineNSC528263DTXSID90326448NSC-528263DS-005071
Database identifiers
- CAS
92961-98-3- PubChem CID
- 352841
- DTXSID
DTXSID90326448
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 38.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 271
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…