2-[chloro(triethyl)-λ5-phosphanyl]ethanol

C8H20ClOP — CID 134993814

IUPAC2-[chloro(triethyl)-λ5-phosphanyl]ethanol
SMILESCCP(Cl)(CC)(CC)CCO
InChIInChI=1S/C8H20ClOP/c1-4-11(9,5-2,6-3)8-7-10/h10H,4-8H2,1-3H3
InChIKeyJPFJGYXLXKQANH-UHFFFAOYSA-N
MW198.67 g/mol
LogP2.75
Rot. Bonds5

About 2-[chloro(triethyl)-λ5-phosphanyl]ethanol

2-[chloro(triethyl)-λ5-phosphanyl]ethanol (PubChem CID 134993814) has the molecular formula C8H20ClOP and a molecular weight of 198.67 g/mol. Its IUPAC name is 2-[chloro(triethyl)-λ5-phosphanyl]ethanol.

Molecular Properties

Compound Name2-[chloro(triethyl)-λ5-phosphanyl]ethanol
PubChem CID134993814
Molecular FormulaC8H20ClOP
Molecular Weight198.67 g/mol
Exact Mass198.09
IUPAC Name2-[chloro(triethyl)-λ5-phosphanyl]ethanol
SMILESCCP(Cl)(CC)(CC)CCO
InChIInChI=1S/C8H20ClOP/c1-4-11(9,5-2,6-3)8-7-10/h10H,4-8H2,1-3H3
InChIKeyJPFJGYXLXKQANH-UHFFFAOYSA-N
XLogP2.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.67
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[chloro(triethyl)-λ5-phosphanyl]ethanol?
The IUPAC name of 2-[chloro(triethyl)-λ5-phosphanyl]ethanol (CID 134993814) is 2-[chloro(triethyl)-λ5-phosphanyl]ethanol.
What is the SMILES notation for 2-[chloro(triethyl)-λ5-phosphanyl]ethanol?
The canonical SMILES for 2-[chloro(triethyl)-λ5-phosphanyl]ethanol is CCP(Cl)(CC)(CC)CCO.
What is the InChIKey of 2-[chloro(triethyl)-λ5-phosphanyl]ethanol?
The InChIKey is JPFJGYXLXKQANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20ClOP/c1-4-11(9,5-2,6-3)8-7-10/h10H,4-8H2,1-3H3.
What are the key properties of 2-[chloro(triethyl)-λ5-phosphanyl]ethanol?
2-[chloro(triethyl)-λ5-phosphanyl]ethanol has a molecular weight of 198.67 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[chloro(triethyl)-λ5-phosphanyl]ethanol is sourced from PubChem (CID 134993814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).