IPH

PHENOL

Created:1999-07-08
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count13
Chiral Atom Count0
Bond Count13
Aromatic Bond Count6
2D diagram of IPH
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Chemical Component Summary

NamePHENOL
Systematic Name (OpenEye OEToolkits)phenol
FormulaC6 H6 O
Molecular Weight94.111
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Oc1ccccc1
SMILESCACTVS3.341Oc1ccccc1
SMILESOpenEye OEToolkits1.5.0c1ccc(cc1)O
Canonical SMILESCACTVS3.341 Oc1ccccc1
Canonical SMILESOpenEye OEToolkits1.5.0 c1ccc(cc1)O
InChIInChI1.03 InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H
InChIKeyInChI1.03 ISWSIDIOOBJBQZ-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB03255 
NamePhenol
Groups
  • approved
  • experimental
DescriptionPhenol is an antiseptic and disinfectant. It is active against a wide range of micro-organisms including some fungi and viruses, but is only slowly effective against spores. Phenol has been used to disinfect skin and to relieve itching. Phenol is also used as an oral analgesic or anesthetic in products such as Chloraseptic to treat pharyngitis. Additionally, phenol and its related compounds are used in surgical ingrown toenail treatment, a process termed phenolization. Research indicates that parental exposure to phenol and its related compounds are positively associated with spontaneous abortion. During the second world war, phenol injections were used as a means of execution by the Nazis. Phenol is a toxic compound whose vapours are corrosive to the skin, eyes, and respiratory tract.
Synonyms
  • Phenylic acid
  • Benzenol
  • Phenol
  • Monohydroxybenzene
  • Fenol
Brand Names
  • ABC Sore Throat Menthol Flavor
  • Blistex Lip
  • Sting-eze-liq
  • TopCare Cherry Flavor
  • Sting Kure - Liq
IndicationPhenol is primarily indicated for minor sore throat pain, sore mouth, minor mouth irritation, and pain associated with canker sores. Additionally, phenol is indicated in the treatment of focal spasticity.
Categories
  • Anesthetics
  • Anesthetics, Local
  • Anti-Infective Agents
  • Anti-Infective Agents, Local
  • Antiseptics and Disinfectants
ATC-Code
  • C05BB05
  • R02AA19
  • N01BX03
  • D08AE03
CAS number108-95-2

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Carbonic anhydrase 1MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSETKHDTSLKPISV...unknowninhibitor
Carbonic anhydrase 4MRMLLALLALSAARPSASAESHWCYEVQAESSNYPCLVPVKWGGNCQKDR...unknowninhibitor
Carbonic anhydrase 12MPRRSLHAAAVLLLVILKEQPSSPAPVNGSKWTYFGPDGENSWSKKYPSC...unknowninhibitor
Carbonic anhydrase 2MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVS...unknowninhibitor
Carbonic anhydrase 14MLFSALLLEVIWILAADGGQHWTYEGPHGQDHWPASYPECGNNAQSPIDI...unknowninhibitor
View More
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 NameReference
PubChem 996, 20488062
ChEMBL CHEMBL14060
ChEBI CHEBI:15882
CCDC/CSD AGOKEN, JIMRON, DEVXOS, JUCYAH, AGOTEV, DIKSAS, FOTBAR, FOTBAR10, JECJAC, EBILOR, LAWWOW, EREKAN, JECHUU, LUNCAB, GOKPAA, CAFVOW, FAJYOF, GOKPAA01, HIBFON, FINPUN, HIBFED, DILSOI, ISEKAS, OLAQAT, MARCIT, BOPDAO, LASXUY, HIBFIH, LODLIB, FORQUB, MITGEB, MPPZPO, GIXNOQ, COHWOL, CUXMOA, KACKOS, AZEZEN
COD 2103472