Ethyl 4-(nonylamino)benzoate
Basic information
- CAS
75681-69-5- Standard SMILES
CCCCCCCCCNc1ccc(C(=O)OCC)cc1- InChIKey
GEANBWWTROCILH-UHFFFAOYSA-N- Molecular formula
- C18H29NO2
- Average molar mass
- 291.4 g/mol
- Monoisotopic mass
- 291.21982917
Names & identifiers
- Preferred name
- Ethyl 4-(nonylamino)benzoate
- IUPAC
- ethyl 4-(nonylamino)benzoate
Names & synonyms
75681-69-5ethyl 4-(nonylamino)benzoateNSC138405Benzoic acid,4-(nonylamino)-, ethyl esterDTXSID70300701NSC-138405DS-010437
Database identifiers
- CAS
75681-69-5- PubChem CID
- 283544
- DTXSID
DTXSID70300701
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 260
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…