ethanol;phosphane

C6H21O3P — CID 159788730

IUPACethanol;phosphane
SMILESCCO.CCO.CCO.P
InChIInChI=1S/3C2H6O.H3P/c3*1-2-3;/h3*3H,2H2,1H3;1H3
InChIKeyNIHCCIIEOQYYEL-UHFFFAOYSA-N
MW172.20 g/mol
LogP0.05
Rot. Bonds

About ethanol;phosphane

ethanol;phosphane (PubChem CID 159788730) has the molecular formula C6H21O3P and a molecular weight of 172.20 g/mol. Its IUPAC name is ethanol;phosphane.

Molecular Properties

Compound Nameethanol;phosphane
PubChem CID159788730
Molecular FormulaC6H21O3P
Molecular Weight172.20 g/mol
Exact Mass172.12
IUPAC Nameethanol;phosphane
SMILESCCO.CCO.CCO.P
InChIInChI=1S/3C2H6O.H3P/c3*1-2-3;/h3*3H,2H2,1H3;1H3
InChIKeyNIHCCIIEOQYYEL-UHFFFAOYSA-N
XLogP0.05
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.20
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze ethanol;phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethanol;phosphane;hydrate
CID 175112469
ethanol iodide
CID 22987629
ethanol;methanol
CID 157119827
ethanol;stibane
CID 170920077
ethanol;hydron
CID 174459614
ethanol;tin(2+)
CID 162004830
azane;ethanol
CID 173204929
ethanol;propane
CID 158736248
ethanol;ruthenium
CID 150841781
ethanol;titanium
CID 25200198
ethanol;heptahydrate
CID 57434370
ethanol;palladium
CID 87368677

Frequently Asked Questions

What is the IUPAC name of ethanol;phosphane?
The IUPAC name of ethanol;phosphane (CID 159788730) is ethanol;phosphane.
What is the SMILES notation for ethanol;phosphane?
The canonical SMILES for ethanol;phosphane is CCO.CCO.CCO.P.
What is the InChIKey of ethanol;phosphane?
The InChIKey is NIHCCIIEOQYYEL-UHFFFAOYSA-N. The full InChI is InChI=1S/3C2H6O.H3P/c3*1-2-3;/h3*3H,2H2,1H3;1H3.
What are the key properties of ethanol;phosphane?
ethanol;phosphane has a molecular weight of 172.20 g/mol, XLogP of 0.05, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;phosphane is sourced from PubChem (CID 159788730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).