[hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid

C8H9O6P — CID 512082

IUPAC[hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid
SMILESCOc1ccc(OP(=O)(O)C(=O)O)cc1
InChIInChI=1S/C8H9O6P/c1-13-6-2-4-7(5-3-6)14-15(11,12)8(9)10/h2-5H,1H3,(H,9,10)(H,11,12)
InChIKeyMNLGQNVSBMBKQH-UHFFFAOYSA-N
MW232.13 g/mol
LogP1.94
Rot. Bonds4

About [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid

[hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid (PubChem CID 512082) has the molecular formula C8H9O6P and a molecular weight of 232.13 g/mol. Its IUPAC name is [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid.

Molecular Properties

Compound Name[hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid
PubChem CID512082
Molecular FormulaC8H9O6P
Molecular Weight232.13 g/mol
Exact Mass232.01
IUPAC Name[hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid
SMILESCOc1ccc(OP(=O)(O)C(=O)O)cc1
InChIInChI=1S/C8H9O6P/c1-13-6-2-4-7(5-3-6)14-15(11,12)8(9)10/h2-5H,1H3,(H,9,10)(H,11,12)
InChIKeyMNLGQNVSBMBKQH-UHFFFAOYSA-N
XLogP1.94
TPSA93.06 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.13
LogP ≤ 51.94
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

(4-methoxyphenoxy)phosphonamidic acid
CID 121349218
(4-methoxyphenyl) hydrogen carbonate
CID 19016633
chloro bis(4-methoxyphenyl) phosphate
CID 19821181
4-methoxybenzoic acid;silver
CID 140722019
4-methoxybenzoic acid;hydrobromide
CID 172731707
1-[ethenyl-(4-methoxyphenoxy)phosphoryl]oxy-4-methoxybenzene
CID 14641380
(E)-1-dimethoxyphosphoryl-2-(4-methoxyphenyl)ethenol
CID 13199975
tris(4-methoxyphenoxy)-sulfanylidene-λ5-phosphane
CID 101396180
7-methoxy-3-phosphonooxynaphthalene-2-carboxylic acid
CID 20793163
1-(4-methoxyphenyl)ethenylphosphonic acid
CID 175025880
N-[methoxy-(4-methoxyphenoxy)phosphoryl]methanamine
CID 23274140
dipotassium;hydride;bis(4-methoxybenzoic acid)
CID 174966715

Frequently Asked Questions

What is the IUPAC name of [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid?
The IUPAC name of [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid (CID 512082) is [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid.
What is the SMILES notation for [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid?
The canonical SMILES for [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid is COc1ccc(OP(=O)(O)C(=O)O)cc1.
What is the InChIKey of [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid?
The InChIKey is MNLGQNVSBMBKQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9O6P/c1-13-6-2-4-7(5-3-6)14-15(11,12)8(9)10/h2-5H,1H3,(H,9,10)(H,11,12).
What are the key properties of [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid?
[hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid has a molecular weight of 232.13 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid is sourced from PubChem (CID 512082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).