2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol

C26H22ClO2P — CID 122666786

IUPAC2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol
SMILESOC(c1ccccc1)(c1ccccc1)C(OPCl)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H22ClO2P/c27-30-29-26(23-17-9-3-10-18-23,24-19-11-4-12-20-24)25(28,21-13-5-1-6-14-21)22-15-7-2-8-16-22/h1-20,28,30H
InChIKeyIHWCEUUVNBDLJA-UHFFFAOYSA-N
MW432.89 g/mol
LogP6.63
Rot. Bonds7

About 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol

2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol (PubChem CID 122666786) has the molecular formula C26H22ClO2P and a molecular weight of 432.89 g/mol. Its IUPAC name is 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol.

Molecular Properties

Compound Name2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol
PubChem CID122666786
Molecular FormulaC26H22ClO2P
Molecular Weight432.89 g/mol
Exact Mass432.10
IUPAC Name2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol
SMILESOC(c1ccccc1)(c1ccccc1)C(OPCl)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H22ClO2P/c27-30-29-26(23-17-9-3-10-18-23,24-19-11-4-12-20-24)25(28,21-13-5-1-6-14-21)22-15-7-2-8-16-22/h1-20,28,30H
InChIKeyIHWCEUUVNBDLJA-UHFFFAOYSA-N
XLogP6.63
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.89
LogP ≤ 56.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

dichloro(phenyl)methanol
CID 25493
1-(4-methoxyphenyl)-1,2,2-triphenylethane-1,2-diol
CID 70611668
1,1,2,3,3,3-hexakis-phenylpropane-1,2-diol
CID 160640649
1,1-diphenylpropane-1,2,2,3-tetrol
CID 54396902
diphenylmethanediol;dihydrochloride
CID 174953837
(1,2-diphenoxy-1,2,2-triphenylethyl)benzene
CID 10164874
sodium;hydride;triphenylmethanol
CID 174537383
dihydroxyphosphanyl dihydrogen phosphite;1,1,2,3,3,3-hexakis-phenylpropane-1,2-diol
CID 160640648
chloro 2-hydroxy-2,2-diphenylacetate
CID 67237911
1,1-bis(3-methylphenyl)-2,2-diphenylethane-1,2-diol
CID 18615291
2,7-Dimethyl-4,4,5,5-tetraphenyl-3,6-dioxa-2,7-disilaoctane
CID 78060809
1,4,7,10-tetraoxacyclododecane;bis(triphenylmethanol)
CID 139194210

Frequently Asked Questions

What is the IUPAC name of 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol?
The IUPAC name of 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol (CID 122666786) is 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol.
What is the SMILES notation for 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol?
The canonical SMILES for 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol is OC(c1ccccc1)(c1ccccc1)C(OPCl)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol?
The InChIKey is IHWCEUUVNBDLJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22ClO2P/c27-30-29-26(23-17-9-3-10-18-23,24-19-11-4-12-20-24)25(28,21-13-5-1-6-14-21)22-15-7-2-8-16-22/h1-20,28,30H.
What are the key properties of 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol?
2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol has a molecular weight of 432.89 g/mol, XLogP of 6.63, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chlorophosphanyloxy-1,1,2,2-tetraphenylethanol is sourced from PubChem (CID 122666786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).