2-Butyl-2-imidazoline
Basic information
- CAS
10443-59-1- Standard SMILES
CCCCC1=NCCN1- InChIKey
XTRFSGCFRISMDG-UHFFFAOYSA-N- Molecular formula
- C7H14N2
- Average molar mass
- 126.2 g/mol
- Monoisotopic mass
- 126.11569846
Names & identifiers
- Preferred name
- 2-Butyl-2-imidazoline
- IUPAC
- 2-butyl-4,5-dihydro-1H-imidazole
Names & synonyms
2-Butyl-2-imidazoline2-IMIDAZOLINE, 2-BUTYL-10443-59-1DTXSID30146485RefChem:1062673DTXCID70689762-butyl-4,5-dihydro-1H-imidazoleBRN 01073201H-Imidazole, 2-butyl-4,5-dihydro-2-n-Butyl-imidazolin5-23-04-00008 (Beilstein Handbook Reference)SCHEMBL7862276
Show more names
AKOS006349311InChI=1/C7H14N2/c1-2-3-4-7-8-5-6-9-7/h2-6H2,1H3,(H,8,9
Database identifiers
- CAS
10443-59-1- PubChem CID
- 25284
- DTXSID
DTXSID30146485- Nikkaji
- J1.290.355C
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 24.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 107
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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