[methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene

C10H13O2P — CID 23272961

IUPAC[methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene
SMILESC/C=C\P(=O)(OC)c1ccccc1
InChIInChI=1S/C10H13O2P/c1-3-9-13(11,12-2)10-7-5-4-6-8-10/h3-9H,1-2H3/b9-3-
InChIKeyYSUNQHGFXCRWTH-OQFOIZHKSA-N
MW196.19 g/mol
LogP2.77
Rot. Bonds3

About [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene

[methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene (PubChem CID 23272961) has the molecular formula C10H13O2P and a molecular weight of 196.19 g/mol. Its IUPAC name is [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene.

Molecular Properties

Compound Name[methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene
PubChem CID23272961
Molecular FormulaC10H13O2P
Molecular Weight196.19 g/mol
Exact Mass196.07
IUPAC Name[methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene
SMILESC/C=C\P(=O)(OC)c1ccccc1
InChIInChI=1S/C10H13O2P/c1-3-9-13(11,12-2)10-7-5-4-6-8-10/h3-9H,1-2H3/b9-3-
InChIKeyYSUNQHGFXCRWTH-OQFOIZHKSA-N
XLogP2.77
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.19
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methoxymethane;[methyl(phenyl)phosphoryl]benzene
CID 90840778
potassium methoxy(phenyl)phosphinate
CID 141246459
[chloro(methoxy)phosphoryl]benzene;phosphoryl trichloride
CID 174937208
[phenylmethoxy(prop-1-enyl)phosphoryl]oxymethylbenzene
CID 72790570
[chloromethyl(methoxy)phosphoryl]benzene
CID 59938019
[2-dimethoxyphosphorylethyl(phenyl)phosphoryl]benzene
CID 15362204
[[(1E,3E)-4-diphenylphosphorylbuta-1,3-dienyl]-phenylphosphoryl]benzene
CID 102152479
but-2-enoyloxy(phenyl)phosphinic acid
CID 151893149
(E)-3-[ethoxy(phenyl)phosphoryl]-N,N-dimethylprop-2-en-1-amine
CID 102144029
[2-bromoethyl(methoxy)phosphoryl]benzene
CID 101393723
[methoxy(phenyl)phosphoryl] methanesulfinate
CID 134992786
ethane;methane;[methyl(phenyl)phosphoryl]benzene
CID 162150444

Frequently Asked Questions

What is the IUPAC name of [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene?
The IUPAC name of [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene (CID 23272961) is [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene.
What is the SMILES notation for [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene?
The canonical SMILES for [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene is C/C=C\P(=O)(OC)c1ccccc1.
What is the InChIKey of [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene?
The InChIKey is YSUNQHGFXCRWTH-OQFOIZHKSA-N. The full InChI is InChI=1S/C10H13O2P/c1-3-9-13(11,12-2)10-7-5-4-6-8-10/h3-9H,1-2H3/b9-3-.
What are the key properties of [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene?
[methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene has a molecular weight of 196.19 g/mol, XLogP of 2.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [methoxy-[(Z)-prop-1-enyl]phosphoryl]benzene is sourced from PubChem (CID 23272961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).