EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
We are looking for a new Chemistry curator to join the ChEBI team. Find out more about it here.
CHEBI:134813 - chlorobutanol
| Formula | C4H7Cl3O |
| Net Charge | 0 |
| Average Mass | 177.458 |
| Monoisotopic Mass | 175.95625 |
| SMILES | CC(C)(O)C(Cl)(Cl)Cl |
| InChI | InChI=1S/C4H7Cl3O/c1-3(2,8)4(5,6)7/h8H,1-2H3 |
| InChIKey | OSASVXMJTNOKOY-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Application: | antiemetic A drug used to prevent nausea or vomiting. An antiemetic may act by a wide range of mechanisms: it might affect the medullary control centres (the vomiting centre and the chemoreceptive trigger zone) or affect the peripheral receptors. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| chlorobutanol (CHEBI:134813) has role antiemetic (CHEBI:50919) |
| chlorobutanol (CHEBI:134813) is a tertiary alcohol (CHEBI:26878) |
| INN | Source |
|---|---|
| clorobutanol | WHO MedNet |
| Synonyms | Source |
|---|---|
| acetochlorone | DrugCentral |
| acetonchloroform | DrugCentral |
| acetone chloroform | DrugCentral |
| Anhydrous chlorobutanol | ChEMBL |
| chlorbutanol | DrugCentral |
| chlorbutol | DrugCentral |
| Manual Xrefs | Databases |
|---|---|
| 3092 | DrugCentral |
| Registry Numbers | Sources |
|---|---|
| CAS:57-15-8 | DrugCentral |
| Citations |
|---|