1,4-Benzenediamine, 2-propoxy-
Basic information
- CAS
30616-99-0- Standard SMILES
CCCOc1cc(N)ccc1N- InChIKey
XFRSLJZKJLHFQQ-UHFFFAOYSA-N- Molecular formula
- C9H14N2O
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.11061307
Names & identifiers
- Preferred name
- 1,4-Benzenediamine, 2-propoxy-
- IUPAC
- 2-propoxybenzene-1,4-diamine
Names & synonyms
1,4-Benzenediamine, 2-propoxy-30616-99-02-propoxybenzene-1,4-diamineSCHEMBL6944870SCHEMBL30433987DTXSID30184685AKOS012980946
Database identifiers
- CAS
30616-99-0- PubChem CID
- 182006
- DTXSID
DTXSID30184685
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 61.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 130
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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