| CAS Number | 1033717-12-2 |
| Catalog Number | AG01B4V3 |
| Chemical Name | 2-(oxan-4-yl)-1H-imidazole |
| IUPAC Name | 2-(oxan-4-yl)-1H-imidazole |
| InChI | InChI=1S/C8H12N2O/c1-5-11-6-2-7(1)8-9-3-4-10-8/h3-4,7H,1-2,5-6H2,(H,9,10) |
| InChI Key | TVMWYYYSKTWBPB-UHFFFAOYSA-N |
| MDL Number | MFCD20687037 |
| Molecular Formula | C8H12N2O |
| Molecular Weight | 152.1937 |
| SMILES | C1OCCC(C2NC=CN=2)C1 |
| Synonyms | 2-(oxan-4-yl)-1H-imidazole,
1033717-12-2,
SCHEMBL1723408,
TVMWYYYSKTWBPB-UHFFFAOYSA-N,
AKOS033932018,
ZINC116936461,
2-(tetrahydro-2H-pyran-4-yl)-1H-imidazole,
Z2507919897,
|
| Complexity | 123 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.197g/mol |
| Monoisotopic Mass | 152.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number