bis[(R)-hydroxy(phenyl)methyl]phosphinate

C14H14O4P- — CID 51394422

IUPACbis[(R)-hydroxy(phenyl)methyl]phosphinate
SMILESO=P([O-])([C@@H](O)c1ccccc1)[C@@H](O)c1ccccc1
InChIInChI=1S/C14H15O4P/c15-13(11-7-3-1-4-8-11)19(17,18)14(16)12-9-5-2-6-10-12/h1-10,13-16H,(H,17,18)/p-1/t13-,14-/m1/s1
InChIKeyYMIKTLVFXBBWKP-ZIAGYGMSSA-M
MW277.24 g/mol
LogP2.01
Rot. Bonds4

About bis[(R)-hydroxy(phenyl)methyl]phosphinate

bis[(R)-hydroxy(phenyl)methyl]phosphinate (PubChem CID 51394422) has the molecular formula C14H14O4P- and a molecular weight of 277.24 g/mol. Its IUPAC name is bis[(R)-hydroxy(phenyl)methyl]phosphinate.

Molecular Properties

Compound Namebis[(R)-hydroxy(phenyl)methyl]phosphinate
PubChem CID51394422
Molecular FormulaC14H14O4P-
Molecular Weight277.24 g/mol
Exact Mass277.06
IUPAC Namebis[(R)-hydroxy(phenyl)methyl]phosphinate
SMILESO=P([O-])([C@@H](O)c1ccccc1)[C@@H](O)c1ccccc1
InChIInChI=1S/C14H15O4P/c15-13(11-7-3-1-4-8-11)19(17,18)14(16)12-9-5-2-6-10-12/h1-10,13-16H,(H,17,18)/p-1/t13-,14-/m1/s1
InChIKeyYMIKTLVFXBBWKP-ZIAGYGMSSA-M
XLogP2.01
TPSA80.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.24
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dimethylphosphoryl(phenyl)methanol
CID 58658737
[[hydroxy(phenyl)methyl]-phenylphosphoryl]-phenylmethanol
CID 3784616
(S)-diphenoxyphosphoryl(phenyl)methanol
CID 36690824
sodium [hydroxy(phenyl)methyl]-(2-triethylgermylethyl)phosphinate
CID 23693660
3-aminopropyl-[hydroxy(phenyl)methyl]phosphinic acid
CID 10059688
(2S)-2-hydroxy-2-phenylacetaldehyde
CID 12536674
3-[2-cyanoethyl-[hydroxy(phenyl)methyl]phosphoryl]propanenitrile
CID 23280679
1,2-diphenylethane-1,2-diol
CID 159073808
(S)-bis(2,2,2-trifluoroethoxy)phosphoryl-phenylmethanol
CID 102473558
diphenylmethanamine;phosphoric acid
CID 67153031
(1R,2R)-1-dimethoxyphosphoryl-2-phenylpropan-1-ol
CID 125471602
diphenylphosphoryl-(4-methylphenyl)methanol
CID 135058741

Frequently Asked Questions

What is the IUPAC name of bis[(R)-hydroxy(phenyl)methyl]phosphinate?
The IUPAC name of bis[(R)-hydroxy(phenyl)methyl]phosphinate (CID 51394422) is bis[(R)-hydroxy(phenyl)methyl]phosphinate.
What is the SMILES notation for bis[(R)-hydroxy(phenyl)methyl]phosphinate?
The canonical SMILES for bis[(R)-hydroxy(phenyl)methyl]phosphinate is O=P([O-])([C@@H](O)c1ccccc1)[C@@H](O)c1ccccc1.
What is the InChIKey of bis[(R)-hydroxy(phenyl)methyl]phosphinate?
The InChIKey is YMIKTLVFXBBWKP-ZIAGYGMSSA-M. The full InChI is InChI=1S/C14H15O4P/c15-13(11-7-3-1-4-8-11)19(17,18)14(16)12-9-5-2-6-10-12/h1-10,13-16H,(H,17,18)/p-1/t13-,14-/m1/s1.
What are the key properties of bis[(R)-hydroxy(phenyl)methyl]phosphinate?
bis[(R)-hydroxy(phenyl)methyl]phosphinate has a molecular weight of 277.24 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis[(R)-hydroxy(phenyl)methyl]phosphinate is sourced from PubChem (CID 51394422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).