IPA

ISOPROPYL ALCOHOL

Created:1999-07-08
Last modified:  2021-03-01

Help

Find related ligands:

Chemical Details

Formal Charge0
Atom Count12
Chiral Atom Count0
Bond Count11
Aromatic Bond Count0
2D diagram of IPA

WebGL does not seem to be available.

This can be caused by an outdated browser, graphics card driver issue, or bad weather. Sometimes, just restarting the browser helps. Also, make sure hardware acceleration is enabled in your browser.

For a list of supported browsers, refer to http://caniuse.com/#feat=webgl.

Toggle HydrogenToggle Labels

Chemical Component Summary

NameISOPROPYL ALCOHOL
Synonyms2-PROPANOL
Systematic Name (OpenEye OEToolkits)propan-2-ol
FormulaC3 H8 O
Molecular Weight60.095
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs11.02OC(C)C
SMILESCACTVS3.352CC(C)O
SMILESOpenEye OEToolkits1.7.0CC(C)O
Canonical SMILESCACTVS3.352 CC(C)O
Canonical SMILESOpenEye OEToolkits1.7.0 CC(C)O
InChIInChI1.03 InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
InChIKeyInChI1.03 KFZMGEQAYNKOFK-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB02325 
NameIsopropyl alcohol
Groups
  • investigational
  • approved
DescriptionAn isomer of 1-propanol. It is a colorless liquid having disinfectant properties. It is used in the manufacture of acetone and its derivatives and as a solvent. Topically, it is used as an antiseptic.
Synonyms
  • 2-Propanol
  • Isopropyl alcohol
  • Isopropanol
  • Alcohol isopropílico
Brand Names
  • MedPride
  • Easy to break-off cleaning and disinfecting swabstick DFB-I
  • AQUA ZAP Alcohol based Hand sanitizer
  • Alcohol Prep Pad Medium
  • CVS Health All Purpose Kit
Categories
  • Alcohols
  • Antiseptics and Disinfectants
  • Compounds used in a research, industrial, or household setting
  • Dermatologicals
  • Miscellaneous Local Anti-infectives
ATC-CodeD08AX05
CAS number67-63-0

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Nitric oxide synthase 3MGNLKSVAQEPGPPCGLGLGLGLGLCGKQGPATPAPEPSRAPASLLPPAP...unknowninhibitor
Oxysterols receptor LXR-betaMSSPTTSSLDTPLPGNGPPQPGAPSSSPTVKEEGPEPWPGGPDPDVPGTD...unknowninhibitor
Heme oxygenase 1MERPQPDSMPQDLSEALKEATKEVHTQAENAEFMRNFQKGQVTRDGFKLV...unknowninhibitor
GTP cyclohydrolase 1MEKGPVRAPAEKPRGARCSNGFPERDPPRPGPSRPAEKPPRPEAKSAQPA...unknowninhibitor
Phospholipase A2, membrane associatedMKTLLLLAVIMIFGLLQAHGNLVNFHRMIKLTTGKEAALSYGFYGCHCGV...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 3776
ChEMBL CHEMBL582
ChEBI CHEBI:17824
CCDC/CSD ASULAD, BEPGOU, BAYJIX, BANROZ, AVEPEX, AVEPUN, BIMQIA, BOXVIU, BUDBUY, ABALEV, AJALAA, AHIJOS, ABITUC01, ABECIW, BUFHAN, BIVFAN, BIVFAN10, ANUTEK, CEPTAV, BUXQUI, BAJCEX, CAMDOJ, CIBLOQ, AXUJAE, COCGEG, CEXBAJ, CESVUU, AMIMCA, AYIXAH, ARAPAN
COD 7216778, 7217593