methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid

C7H13O4P — CID 130373144

IUPACmethyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid
SMILESC=C(C)C(=O)OCCP(C)(=O)O
InChIInChI=1S/C7H13O4P/c1-6(2)7(8)11-4-5-12(3,9)10/h1,4-5H2,2-3H3,(H,9,10)
InChIKeyYVGZHMTVVCUMKT-UHFFFAOYSA-N
MW192.15 g/mol
LogP1.01
Rot. Bonds4

About methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid

methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid (PubChem CID 130373144) has the molecular formula C7H13O4P and a molecular weight of 192.15 g/mol. Its IUPAC name is methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid.

Molecular Properties

Compound Namemethyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid
PubChem CID130373144
Molecular FormulaC7H13O4P
Molecular Weight192.15 g/mol
Exact Mass192.06
IUPAC Namemethyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid
SMILESC=C(C)C(=O)OCCP(C)(=O)O
InChIInChI=1S/C7H13O4P/c1-6(2)7(8)11-4-5-12(3,9)10/h1,4-5H2,2-3H3,(H,9,10)
InChIKeyYVGZHMTVVCUMKT-UHFFFAOYSA-N
XLogP1.01
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.15
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

methyl-[4-(2-methylprop-2-enoyloxy)butyl]phosphinic acid
CID 139843889
methyl-[2-[2-(2-methylprop-2-enoyloxy)ethylsulfanyl]ethyl]phosphinic acid
CID 158708076
3-(2-methylprop-2-enoyloxy)propyl 2-methylprop-2-enoate;phosphoric acid
CID 87531056
2-aminoethyl 2-methylprop-2-enoate;phosphoric acid
CID 86256248
bis[4-(2-methylprop-2-enoyloxy)butyl]phosphinic acid
CID 87234792
ethene;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 173009937
ethyl-[3-(2-methylprop-2-enoyloxy)propyl]phosphinic acid
CID 139789755
2-dimethylphosphoryloxyethyl 2-methylprop-2-enoate
CID 54281312
dilithium;2-(2-methylprop-2-enoyloxy)ethyl phosphate
CID 122611995
ethylphosphonic acid;2-hydroxyethyl 2-methylprop-2-enoate
CID 174621841
sodium 2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl hydrogen phosphate
CID 122613092
2-bromoethyl-[2-(2-methylprop-2-enoyloxy)ethoxy]phosphinic acid
CID 175167107

Frequently Asked Questions

What is the IUPAC name of methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid?
The IUPAC name of methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid (CID 130373144) is methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid.
What is the SMILES notation for methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid?
The canonical SMILES for methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid is C=C(C)C(=O)OCCP(C)(=O)O.
What is the InChIKey of methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid?
The InChIKey is YVGZHMTVVCUMKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13O4P/c1-6(2)7(8)11-4-5-12(3,9)10/h1,4-5H2,2-3H3,(H,9,10).
What are the key properties of methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid?
methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid has a molecular weight of 192.15 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[2-(2-methylprop-2-enoyloxy)ethyl]phosphinic acid is sourced from PubChem (CID 130373144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).