Basic information
- Standard SMILES
CC(C)O.CCCCCC.CCNCC- InChIKey
PUUZLWLFYQFYCF-UHFFFAOYSA-N- Molecular formula
- C13H33NO
- Average molar mass
- 219.41 g/mol
- Monoisotopic mass
- 219.25621468
Names & identifiers
- Preferred name
- Hexane isopropanol diethylamine
- IUPAC
- N-ethylethanamine;hexane;propan-2-ol
Names & synonyms
hexane isopropanol diethylamineSCHEMBL602813hexane 2-propanol diethylaminePUUZLWLFYQFYCF-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 21973129
Properties
Computed structural properties
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 33.9
Related reactions
16 records
Compound notes
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