methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate

C15H15O4P — CID 819526

IUPACmethyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate
SMILESCOC(=O)[C@H](O)P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15O4P/c1-19-14(16)15(17)20(18,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,15,17H,1H3/t15-/m1/s1
InChIKeyAOGJPYRFILRTHL-OAHLLOKOSA-N
MW290.26 g/mol
LogP1.49
Rot. Bonds4

About methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate

methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate (PubChem CID 819526) has the molecular formula C15H15O4P and a molecular weight of 290.26 g/mol. Its IUPAC name is methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate.

Molecular Properties

Compound Namemethyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate
PubChem CID819526
Molecular FormulaC15H15O4P
Molecular Weight290.26 g/mol
Exact Mass290.07
IUPAC Namemethyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate
SMILESCOC(=O)[C@H](O)P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15O4P/c1-19-14(16)15(17)20(18,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,15,17H,1H3/t15-/m1/s1
InChIKeyAOGJPYRFILRTHL-OAHLLOKOSA-N
XLogP1.49
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.26
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl 3-diphenylphosphoryl-3-phenylpropanoate
CID 139256756
methyl (3R)-3-diphenylphosphoryl-3-phenylpropanoate
CID 102493910
4-diphenylphosphorylpentan-2-one
CID 13202508
methyl 2-diphenylphosphoryl-2-[2-[(Z)-N-methoxy-C-methylcarbonimidoyl]phenyl]acetate
CID 102293561
ethyl 2-diphenylphosphorylbutanoate
CID 3289808
methyl (2S)-2-benzamidopropanoate
CID 6364617
methyl (2S)-2-dimethoxyphosphoryl-2-phenylacetate
CID 129384892
methyl (3S)-2,3-dihydroxy-4-phenylbutanoate
CID 129084711
methyl 2-anilinopropanoate
CID 3417283
diphenylphosphorylbenzene;methyl N-(methoxycarbonylamino)carbamate
CID 139081479
methyl (2S)-2-[[(2E)-1-diphenylphosphoryl-2-hydroxyiminopropyl]amino]-3-phenylpropanoate
CID 16741928
dimethyl 2-phenylpropanedioate;ethane
CID 91499304

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate?
The IUPAC name of methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate (CID 819526) is methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate.
What is the SMILES notation for methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate?
The canonical SMILES for methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate is COC(=O)[C@H](O)P(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate?
The InChIKey is AOGJPYRFILRTHL-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H15O4P/c1-19-14(16)15(17)20(18,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,15,17H,1H3/t15-/m1/s1.
What are the key properties of methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate?
methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate has a molecular weight of 290.26 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-2-diphenylphosphoryl-2-hydroxyacetate is sourced from PubChem (CID 819526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).