Basic information
- CAS
21631-82-3- Standard SMILES
CCCCCCCCCCCCCC1=NCCN1- InChIKey
UKJKJYIQYXYUSG-UHFFFAOYSA-N- Molecular formula
- C16H32N2
- Average molar mass
- 252.44 g/mol
- Monoisotopic mass
- 252.25654903
Names & identifiers
- Preferred name
- 2-Imidazoline, 2-tridecyl-
- IUPAC
- 2-tridecyl-4,5-dihydro-1H-imidazole
Names & synonyms
2-IMIDAZOLINE, 2-TRIDECYL-2-Tridecyl-2-imidazolineBRN 0138551DTXSID3017602521631-82-35-23-04-00114 (Beilstein Handbook Reference)RefChem:262026DTXCID40985162-tridecylimidazoline2-tridecyl-4,5-dihydro-1H-imidazoleSCHEMBL5675527
Database identifiers
- CAS
21631-82-3- PubChem CID
- 30719
- DTXSID
DTXSID30176025
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 24.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 12
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 211
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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