Basic information
- CAS
434312-02-4- Standard SMILES
CC(C)NCCCCOc1ccc(Cl)c(Cl)c1- InChIKey
BTOZMJFMDDECGM-UHFFFAOYSA-N- Molecular formula
- C13H19Cl2NO
- Average molar mass
- 276.2 g/mol
- Monoisotopic mass
- 275.0843696
Names & identifiers
- Preferred name
- 4-(3,4-Dichlorophenoxy)-N-(1-methylethyl)-1-butanamine
- IUPAC
- 4-(3,4-dichlorophenoxy)-N-propan-2-ylbutan-1-amine
Names & synonyms
4-(3,4-Dichlorophenoxy)-N-(1-methylethyl)-1-butanamine434312-02-4DTXSID601210723AKOS0117753864-(3,4-Dichlorophenoxy)-N-(propan-2-yl)butan-1-amine
Database identifiers
- CAS
434312-02-4- PubChem CID
- 2298232
- DTXSID
DTXSID601210723
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 202
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…