4-(2-Chlorophenoxy)butan-1-amine
Basic information
- CAS
57276-68-3- Standard SMILES
NCCCCOc1ccccc1Cl- InChIKey
IMEANRDXCNBMAU-UHFFFAOYSA-N- Molecular formula
- C10H14ClNO
- Average molar mass
- 199.68 g/mol
- Monoisotopic mass
- 199.0763918
Names & identifiers
- Preferred name
- 4-(2-Chlorophenoxy)butan-1-amine
- IUPAC
- 4-(2-chlorophenoxy)butan-1-amine
Names & synonyms
4-(2-chlorophenoxy)butan-1-amine57276-68-31-(4-AMINOBUTOXY)-2-CHLOROBENZENESCHEMBL11708352DTXSID9013019614-(2-Chlorophenoxy)-1-butanamineAKOS000345332CS-0299996EN300-242791
Database identifiers
- CAS
57276-68-3- PubChem CID
- 20109592
- DTXSID
DTXSID901301961
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 132
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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