N-Carbamoylimidazole - CAS 2578-41-8
Catalog: |
BB070655 |
Product Name: |
N-Carbamoylimidazole |
CAS: |
2578-41-8 |
Synonyms: |
1h-imidazole-1-carboxamide; Imidazole-1-carboxamide |
IUPAC Name: | imidazole-1-carboxamide |
Molecular Weight: | 111.1 |
Molecular Formula: | C4H5N3O |
Canonical SMILES: | C1=CN(C=N1)C(=O)N |
InChI: | InChI=1S/C4H5N3O/c5-4(8)7-2-1-6-3-7/h1-3H,(H2,5,8) |
InChI Key: | CLIDMUTWHLMPMN-UHFFFAOYSA-N |
Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 111.043261792 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 111.043261792 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 60.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.9 |
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