2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol

C10H15O5P — CID 102595355

IUPAC2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol
SMILESCOP(=O)(C[C@H](O)c1ccccc1O)OC
InChIInChI=1S/C10H15O5P/c1-14-16(13,15-2)7-10(12)8-5-3-4-6-9(8)11/h3-6,10-12H,7H2,1-2H3/t10-/m0/s1
InChIKeyLGVZZHMBWPSLAU-JTQLQIEISA-N
MW246.20 g/mol
LogP1.91
Rot. Bonds5

About 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol

2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol (PubChem CID 102595355) has the molecular formula C10H15O5P and a molecular weight of 246.20 g/mol. Its IUPAC name is 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol.

Molecular Properties

Compound Name2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol
PubChem CID102595355
Molecular FormulaC10H15O5P
Molecular Weight246.20 g/mol
Exact Mass246.07
IUPAC Name2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol
SMILESCOP(=O)(C[C@H](O)c1ccccc1O)OC
InChIInChI=1S/C10H15O5P/c1-14-16(13,15-2)7-10(12)8-5-3-4-6-9(8)11/h3-6,10-12H,7H2,1-2H3/t10-/m0/s1
InChIKeyLGVZZHMBWPSLAU-JTQLQIEISA-N
XLogP1.91
TPSA75.99 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.20
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-dimethoxyphosphoryl-1-(2-methoxyphenyl)ethanol
CID 117060650
(1R)-1-(2-aminophenyl)-2-dimethoxyphosphorylethanol
CID 101339254
1-(5-amino-2,4-diiodophenyl)-2-dimethoxyphosphorylethanol
CID 10648954
ethyl 3-hydroxy-3-(2-hydroxyphenyl)propanoate
CID 11183417
[[2-[[[hydroxy(methyl)phosphoryl]-(2-hydroxyphenyl)methyl]amino]ethylamino]-(2-hydroxyphenyl)methyl]-methylphosphinic acid
CID 23422856
2-(2-aminooxy-1-hydroxyethyl)phenol
CID 105434025
[3-dimethoxyphosphoryl-2-(dimethoxyphosphorylmethyl)propyl]benzene
CID 14030878
2-[(1S)-1-hydroxy-2-phenylethyl]phenol
CID 86312713
1-(2-hydroxyphenyl)ethylphosphonic acid
CID 165144464
(2R,3S)-3-(dibenzylamino)-1-dimethoxyphosphoryl-4-phenylbutan-2-ol
CID 11190239
2-[(S)-amino(diethoxyphosphoryl)methyl]phenol
CID 171191680
2-(2-hydroxyphenyl)-2-(2-methoxyethylamino)acetamide
CID 116684995

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol?
The IUPAC name of 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol (CID 102595355) is 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol.
What is the SMILES notation for 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol?
The canonical SMILES for 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol is COP(=O)(C[C@H](O)c1ccccc1O)OC.
What is the InChIKey of 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol?
The InChIKey is LGVZZHMBWPSLAU-JTQLQIEISA-N. The full InChI is InChI=1S/C10H15O5P/c1-14-16(13,15-2)7-10(12)8-5-3-4-6-9(8)11/h3-6,10-12H,7H2,1-2H3/t10-/m0/s1.
What are the key properties of 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol?
2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol has a molecular weight of 246.20 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-2-dimethoxyphosphoryl-1-hydroxyethyl]phenol is sourced from PubChem (CID 102595355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).