Basic information
- CAS
886498-10-8- Standard SMILES
CCCCn1ccnc1CN- InChIKey
LXKDNTVSXMDYTF-UHFFFAOYSA-N- Molecular formula
- C8H15N3
- Average molar mass
- 153.22 g/mol
- Monoisotopic mass
- 153.12659749
Names & identifiers
- Preferred name
- (1-Butylimidazol-2-yl)methanamine
- IUPAC
- (1-butylimidazol-2-yl)methanamine
- English name
- C-(1-BUTYL-1H-IMIDAZOL-2-YL)-METHYLAMINE 2HCL
- Molecular formula
- C8H15N3
- Molecular weight
- 153.22
Names & synonyms
886498-10-8(1-butylimidazol-2-yl)methanamine(1-Butyl-1H-imidazol-2-yl)methanamine[(1-butyl-1H-imidazol-2-yl)methyl]amine dihydrochlorideC-(1-Butyl-1H-imidazol-2-yl)-methylamine1-(1-butyl-1H-imidazol-2-yl)methanamine dihydrochlorideSCHEMBL949578ALBB-015253AKOS003593763CS-03627671H-Imidazole-2-methanamine, 1-butyl-C-(1-BUTYL-1H-IMIDAZOL-2-YL)-METHYLAMINE 2HCL
Database identifiers
- CAS
886498-10-8- PubChem CID
- 4777638
- Nikkaji
- J3.397.009I
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 106
Physicochemical properties
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314-H290
- Precautionary statements
- 501 · P501-P234-P264-P280-P390-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P406-P405
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_class
- IRRITANT
- Hazard statements
- H314-H290
- Precautionary statements
- P501-P234-P264-P280-P390-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P406-P405
Chemistry & industry
Suppliers4 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…