methoxy-methyl-diphenylphosphanium

C14H16OP+ — CID 23415298

IUPACmethoxy-methyl-diphenylphosphanium
SMILESCO[P+](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H16OP/c1-15-16(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3/q+1
InChIKeyHJGPTBVCWSCBDW-UHFFFAOYSA-N
MW231.25 g/mol
LogP2.85
Rot. Bonds3

About methoxy-methyl-diphenylphosphanium

methoxy-methyl-diphenylphosphanium (PubChem CID 23415298) has the molecular formula C14H16OP+ and a molecular weight of 231.25 g/mol. Its IUPAC name is methoxy-methyl-diphenylphosphanium.

Molecular Properties

Compound Namemethoxy-methyl-diphenylphosphanium
PubChem CID23415298
Molecular FormulaC14H16OP+
Molecular Weight231.25 g/mol
Exact Mass231.09
IUPAC Namemethoxy-methyl-diphenylphosphanium
SMILESCO[P+](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H16OP/c1-15-16(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3/q+1
InChIKeyHJGPTBVCWSCBDW-UHFFFAOYSA-N
XLogP2.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

methoxy(triphenyl)phosphanium;hydrobromide
CID 174550748
[(2S)-2-methoxypropyl]-triphenylphosphanium
CID 98159687
1-methoxyethoxybenzene
CID 18188895
manganese(2+);methyl(triphenyl)phosphanium;dibromide
CID 175373163
methyl-diphenyl-propan-2-ylphosphanium
CID 23412999
3,3-dimethoxypropyl(triphenyl)phosphanium
CID 10621039
[(2R)-2-methoxy-1-phenylpropyl]benzene
CID 101223865
hydroxy-phenyl-di(propan-2-yl)phosphanium
CID 67469476
triphenyl(propan-2-yl)phosphanium hydroxide
CID 18356098
2-methoxypropyl(diphenyl)phosphane
CID 23413688
[(2S)-2-methoxypropyl]-diphenylphosphane
CID 10658854
methyl carbonobromidate;methyl(triphenyl)phosphanium
CID 146562792

Frequently Asked Questions

What is the IUPAC name of methoxy-methyl-diphenylphosphanium?
The IUPAC name of methoxy-methyl-diphenylphosphanium (CID 23415298) is methoxy-methyl-diphenylphosphanium.
What is the SMILES notation for methoxy-methyl-diphenylphosphanium?
The canonical SMILES for methoxy-methyl-diphenylphosphanium is CO[P+](C)(c1ccccc1)c1ccccc1.
What is the InChIKey of methoxy-methyl-diphenylphosphanium?
The InChIKey is HJGPTBVCWSCBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16OP/c1-15-16(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3/q+1.
What are the key properties of methoxy-methyl-diphenylphosphanium?
methoxy-methyl-diphenylphosphanium has a molecular weight of 231.25 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-methyl-diphenylphosphanium is sourced from PubChem (CID 23415298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).