methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid

C6H11O5P — CID 155926813

IUPACmethoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid
SMILESC=C(C)C(=O)OCP(=O)(O)OC
InChIInChI=1S/C6H11O5P/c1-5(2)6(7)11-4-12(8,9)10-3/h1,4H2,2-3H3,(H,8,9)
InChIKeyDSERITUOYTYZKB-UHFFFAOYSA-N
MW194.12 g/mol
LogP0.89
Rot. Bonds4

About methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid

methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid (PubChem CID 155926813) has the molecular formula C6H11O5P and a molecular weight of 194.12 g/mol. Its IUPAC name is methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid.

Molecular Properties

Compound Namemethoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid
PubChem CID155926813
Molecular FormulaC6H11O5P
Molecular Weight194.12 g/mol
Exact Mass194.03
IUPAC Namemethoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid
SMILESC=C(C)C(=O)OCP(=O)(O)OC
InChIInChI=1S/C6H11O5P/c1-5(2)6(7)11-4-12(8,9)10-3/h1,4H2,2-3H3,(H,8,9)
InChIKeyDSERITUOYTYZKB-UHFFFAOYSA-N
XLogP0.89
TPSA72.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.12
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

2-methylprop-2-enoyloxymethyl(propan-2-yloxy)phosphinic acid
CID 123217375
3-(2-methylprop-2-enoyloxy)propyl 2-methylprop-2-enoate;phosphoric acid
CID 87531056
methoxy(methoxymethyl)phosphinic acid
CID 54547216
methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid
CID 130373144
2-aminoethyl 2-methylprop-2-enoate;phosphoric acid
CID 86256248
dodecyl(2-methylprop-2-enoyloxymethyl)phosphinic acid
CID 139843859
sodium;ethyl 2-methylprop-2-enoate;hydride
CID 173442862
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 22918033
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 162171139
hydroxymethyl 2-methylprop-2-enoate
CID 159274421
ethyl 2-methylprop-2-enoate
CID 130475774
ethene;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 173009937

Frequently Asked Questions

What is the IUPAC name of methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid?
The IUPAC name of methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid (CID 155926813) is methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid.
What is the SMILES notation for methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid?
The canonical SMILES for methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid is C=C(C)C(=O)OCP(=O)(O)OC.
What is the InChIKey of methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid?
The InChIKey is DSERITUOYTYZKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11O5P/c1-5(2)6(7)11-4-12(8,9)10-3/h1,4H2,2-3H3,(H,8,9).
What are the key properties of methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid?
methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid has a molecular weight of 194.12 g/mol, XLogP of 0.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy(2-methylprop-2-enoyloxymethyl)phosphinic acid is sourced from PubChem (CID 155926813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).