Chemical Component Summary | |
|---|---|
| Name | 4-chlorophenol |
| Identifiers | 4-chlorophenol |
| Formula | C6 H5 Cl O |
| Molecular Weight | 128.556 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1cc(ccc1O)Cl |
| InChI | InChI=1S/C6H5ClO/c7-5-1-3-6(8)4-2-5/h1-4,8H |
| InChIKey | WXNZTHHGJRFXKQ-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 13 |
| Chiral Atom Count | 0 |
| Bond Count | 13 |
| Aromatic Bond Count | 6 |
Drug Info: DrugBank
| DrugBank ID | DB13154? |
|---|---|
| Name | Parachlorophenol |
| Groups | approved |
| Description | P-chlorophenol is a white crystals with a strong phenol odor. Slightly soluble to soluble in water, depending on the isomer, and denser than water. Noncombustible. |
| Synonyms |
|
| Brand Names |
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| Indication | Used as an intermediate in organic synthesis of dyes and drugs. Local antibacterial agent in root canal therapy, as topical antiseptic in ointments |
| Categories |
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| CAS number | 106-48-9 |
Drug Targets
| Name | Target Sequence | Pharmacological Action | Actions |
|---|---|---|---|
| Sodium channel protein type 4 subunit alpha | MARPSLCTLVPLGPECLRPFTRESLAAIEQRAVEEEARLQRNKQMEIEEP... | unknown | |
| Solute carrier organic anion transporter family member 1B3 | MDQHQHLNKTAESASSEKKKTRRCNGFKMFLAALSFSYIAKALGGIIMKI... | unknown | substrate |
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison
T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS.
Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 4684 |
| ChEMBL | CHEMBL57053 |
| ChEBI | CHEBI:28078 |
| CCDC/CSD | SUFFOO, BNQCLP01, BNQDCP02, CEPZUV, UZOXOX, CLPHOL12, SARLEC, AYEPUR, CEQBAE, HIBGII, CLPHOL13, HIFTIA, NEVMEH, ULUZOS, CLPHOL14, CIMMOD, ISEKIA, APUJIH |
| COD | 2100150, 2100151, 2100152 |
