2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol

C10H14ClO2P — CID 23082166

IUPAC2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol
SMILESOCCP(CCO)c1cccc(Cl)c1
InChIInChI=1S/C10H14ClO2P/c11-9-2-1-3-10(8-9)14(6-4-12)7-5-13/h1-3,8,12-13H,4-7H2
InChIKeyKKUABSFVGOZLLR-UHFFFAOYSA-N
MW232.65 g/mol
LogP1.43
Rot. Bonds5

About 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol

2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol (PubChem CID 23082166) has the molecular formula C10H14ClO2P and a molecular weight of 232.65 g/mol. Its IUPAC name is 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol.

Molecular Properties

Compound Name2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol
PubChem CID23082166
Molecular FormulaC10H14ClO2P
Molecular Weight232.65 g/mol
Exact Mass232.04
IUPAC Name2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol
SMILESOCCP(CCO)c1cccc(Cl)c1
InChIInChI=1S/C10H14ClO2P/c11-9-2-1-3-10(8-9)14(6-4-12)7-5-13/h1-3,8,12-13H,4-7H2
InChIKeyKKUABSFVGOZLLR-UHFFFAOYSA-N
XLogP1.43
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.65
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3-dichlorobenzene;sulfanol
CID 174381890
3-(3-chlorophenyl)-3,3-difluoropropan-1-ol
CID 105459745
1,3-dichlorobenzene;guanidine
CID 174959611
1,3-dichlorobenzene;trihydrofluoride
CID 172846672
azane;1,3-dichlorobenzene
CID 67301049
2-[2-(3-chlorophenoxy)ethoxy]ethanol
CID 10443322
sodium;1,3-dichlorobenzene;hydride
CID 175271520
magnesium;1,3-dichlorobenzene;hydride
CID 173052292
butane;1,3-dichlorobenzene
CID 174455068
(3-chlorophenyl)methanediol
CID 20679602
1-chloro-3-(2-phenylphenyl)benzene
CID 69293962
CID 68547080
CID 68547080

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol?
The IUPAC name of 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol (CID 23082166) is 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol.
What is the SMILES notation for 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol?
The canonical SMILES for 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol is OCCP(CCO)c1cccc(Cl)c1.
What is the InChIKey of 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol?
The InChIKey is KKUABSFVGOZLLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClO2P/c11-9-2-1-3-10(8-9)14(6-4-12)7-5-13/h1-3,8,12-13H,4-7H2.
What are the key properties of 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol?
2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol has a molecular weight of 232.65 g/mol, XLogP of 1.43, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol is sourced from PubChem (CID 23082166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).