methoxy(3-prop-2-enoyloxypropyl)phosphinic acid

C7H13O5P — CID 154634835

IUPACmethoxy(3-prop-2-enoyloxypropyl)phosphinic acid
SMILESC=CC(=O)OCCCP(=O)(O)OC
InChIInChI=1S/C7H13O5P/c1-3-7(8)12-5-4-6-13(9,10)11-2/h3H,1,4-6H2,2H3,(H,9,10)
InChIKeyUXFSKVRCWIVLCM-UHFFFAOYSA-N
MW208.15 g/mol
LogP0.94
Rot. Bonds6

About methoxy(3-prop-2-enoyloxypropyl)phosphinic acid

methoxy(3-prop-2-enoyloxypropyl)phosphinic acid (PubChem CID 154634835) has the molecular formula C7H13O5P and a molecular weight of 208.15 g/mol. Its IUPAC name is methoxy(3-prop-2-enoyloxypropyl)phosphinic acid.

Molecular Properties

Compound Namemethoxy(3-prop-2-enoyloxypropyl)phosphinic acid
PubChem CID154634835
Molecular FormulaC7H13O5P
Molecular Weight208.15 g/mol
Exact Mass208.05
IUPAC Namemethoxy(3-prop-2-enoyloxypropyl)phosphinic acid
SMILESC=CC(=O)OCCCP(=O)(O)OC
InChIInChI=1S/C7H13O5P/c1-3-7(8)12-5-4-6-13(9,10)11-2/h3H,1,4-6H2,2H3,(H,9,10)
InChIKeyUXFSKVRCWIVLCM-UHFFFAOYSA-N
XLogP0.94
TPSA72.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.15
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze methoxy(3-prop-2-enoyloxypropyl)phosphinic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methoxybutyl prop-2-enoate
CID 22321356
10-[hydroxy(methoxy)phosphoryl]oxydecyl prop-2-enoate
CID 140975270
3-[methoxy(methyl)phosphoryl]oxypropyl prop-2-enoate
CID 118588496
phosphoric acid;3-trimethoxysilylpropyl prop-2-enoate
CID 174981814
hexadecyl(4-prop-2-enoyloxybutyl)phosphinic acid
CID 139843854
octyl(6-prop-2-enoyloxyhexyl)phosphinic acid
CID 139843819
8-prop-2-enoyloxyoctyl prop-2-enoate
CID 12934232
azane;3-prop-2-enoyloxypropyl prop-2-enoate
CID 162679005
4-prop-2-enoyloxybutyl prop-2-enoate;6-prop-2-enoyloxyhexyl prop-2-enoate
CID 158256375
9-[hydroxy(9-prop-2-enoyloxynonoxy)phosphoryl]oxynonyl prop-2-enoate
CID 138489892
2-prop-2-enoyloxyethoxy(2-prop-2-enoyloxyethyl)phosphinic acid
CID 87504188
3-hydroxypropyl prop-2-enoate;prop-1-en-2-ylphosphonic acid
CID 86739384

Frequently Asked Questions

What is the IUPAC name of methoxy(3-prop-2-enoyloxypropyl)phosphinic acid?
The IUPAC name of methoxy(3-prop-2-enoyloxypropyl)phosphinic acid (CID 154634835) is methoxy(3-prop-2-enoyloxypropyl)phosphinic acid.
What is the SMILES notation for methoxy(3-prop-2-enoyloxypropyl)phosphinic acid?
The canonical SMILES for methoxy(3-prop-2-enoyloxypropyl)phosphinic acid is C=CC(=O)OCCCP(=O)(O)OC.
What is the InChIKey of methoxy(3-prop-2-enoyloxypropyl)phosphinic acid?
The InChIKey is UXFSKVRCWIVLCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13O5P/c1-3-7(8)12-5-4-6-13(9,10)11-2/h3H,1,4-6H2,2H3,(H,9,10).
What are the key properties of methoxy(3-prop-2-enoyloxypropyl)phosphinic acid?
methoxy(3-prop-2-enoyloxypropyl)phosphinic acid has a molecular weight of 208.15 g/mol, XLogP of 0.94, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy(3-prop-2-enoyloxypropyl)phosphinic acid is sourced from PubChem (CID 154634835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).