|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
29
Total Number of Articles : 70
|
| PubChem |
130600
|
| Molecular Formula |
C6H11NO |
| SMILES |
CC(C)(C[N+]#[C-])OC |
| InChI |
InChI=1S/C6H11NO/c1-6(2,8-4)5-7-3/h5H2,1-2,4H3 |
| synonyms |
- 109434-22-2
- 1-isocyano-2-methoxy-2-methylpropane
- 2-Methoxyisobutylisonitrile
- MIBI
- 1-ISOCYANO-2-METHOXY-2-METHYL-PROPANE
- 2-methoxyisobutyl isonitrile
- 2-METHOXYISOBUTYL ISOCYANIDE
- 2K3X4G63S7
- RP-30
- UNII-2K3X4G63S7
- SCHEMBL292018
- 2-methoxy-isobutyl-isoni-trile
- DTXSID20148933
- LJJFNFYPZOHRHM-UHFFFAOYSA-N
- 2-Methoxyisobutylisonitrile (MIBI)
- BBL101192
- STL554988
- AKOS006285965
- GS-0283
- Propane, 1-isocyano-2-methoxy-2-methyl-
- EN300-1840173
- Q27254854
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|
| Properties |
| Property |
Value |
| MW |
113.16 g/mol |
| HBD |
0 |
| HBA |
2 |
| Rotatable Bond Count |
2 |
| Exact Mass |
113.084063974 g/mol |
| Monoisotopic Mass |
113.084063974 g/mol |
| Heavy Atom Count |
8 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
109 |
| xlogp |
0.4 |
| Topological Polar Surface Area |
13.6 |
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