[methoxy(prop-2-enyl)phosphoryl]oxybenzene

C10H13O3P — CID 54095203

IUPAC[methoxy(prop-2-enyl)phosphoryl]oxybenzene
SMILESC=CCP(=O)(OC)Oc1ccccc1
InChIInChI=1S/C10H13O3P/c1-3-9-14(11,12-2)13-10-7-5-4-6-8-10/h3-8H,1,9H2,2H3
InChIKeyMWQDPDDKIOLMJK-UHFFFAOYSA-N
MW212.19 g/mol
LogP3.09
Rot. Bonds5

About [methoxy(prop-2-enyl)phosphoryl]oxybenzene

[methoxy(prop-2-enyl)phosphoryl]oxybenzene (PubChem CID 54095203) has the molecular formula C10H13O3P and a molecular weight of 212.19 g/mol. Its IUPAC name is [methoxy(prop-2-enyl)phosphoryl]oxybenzene.

Molecular Properties

Compound Name[methoxy(prop-2-enyl)phosphoryl]oxybenzene
PubChem CID54095203
Molecular FormulaC10H13O3P
Molecular Weight212.19 g/mol
Exact Mass212.06
IUPAC Name[methoxy(prop-2-enyl)phosphoryl]oxybenzene
SMILESC=CCP(=O)(OC)Oc1ccccc1
InChIInChI=1S/C10H13O3P/c1-3-9-14(11,12-2)13-10-7-5-4-6-8-10/h3-8H,1,9H2,2H3
InChIKeyMWQDPDDKIOLMJK-UHFFFAOYSA-N
XLogP3.09
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.19
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[methoxy-[[methoxy(phenoxy)phosphoryl]methyl]phosphoryl]oxybenzene;dihydrate
CID 87979302
[2-dimethoxyphosphorylethyl(phenoxy)phosphoryl]oxybenzene
CID 132915786
1-methyl-4-[(4-methylphenoxy)-prop-2-enylphosphoryl]oxybenzene
CID 87155254
ethyl (2R)-2-[phenoxy(prop-2-enyl)phosphoryl]oxypropanoate
CID 91195065
[butyl(methoxy)phosphoryl]oxybenzene
CID 125474824
4-[(4-hydroxyphenoxy)-prop-2-enylphosphoryl]oxyphenol
CID 88768896
[methoxy(methyl)phosphoryl]oxybenzene
CID 564592
[2-diphenoxyphosphorylethyl(phenoxy)phosphoryl]oxybenzene
CID 14550387
ethenyl methyl phenyl phosphate
CID 11593721
2-[formyl-[[methoxy(phenoxy)phosphoryl]methyl]amino]acetic acid
CID 88709753
dimethyl phenyl phosphate;ethane;trimethyl phosphate
CID 90867053
[but-3-enyl(chloro)phosphoryl]oxybenzene
CID 177370150

Frequently Asked Questions

What is the IUPAC name of [methoxy(prop-2-enyl)phosphoryl]oxybenzene?
The IUPAC name of [methoxy(prop-2-enyl)phosphoryl]oxybenzene (CID 54095203) is [methoxy(prop-2-enyl)phosphoryl]oxybenzene.
What is the SMILES notation for [methoxy(prop-2-enyl)phosphoryl]oxybenzene?
The canonical SMILES for [methoxy(prop-2-enyl)phosphoryl]oxybenzene is C=CCP(=O)(OC)Oc1ccccc1.
What is the InChIKey of [methoxy(prop-2-enyl)phosphoryl]oxybenzene?
The InChIKey is MWQDPDDKIOLMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13O3P/c1-3-9-14(11,12-2)13-10-7-5-4-6-8-10/h3-8H,1,9H2,2H3.
What are the key properties of [methoxy(prop-2-enyl)phosphoryl]oxybenzene?
[methoxy(prop-2-enyl)phosphoryl]oxybenzene has a molecular weight of 212.19 g/mol, XLogP of 3.09, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [methoxy(prop-2-enyl)phosphoryl]oxybenzene is sourced from PubChem (CID 54095203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).