triphenyl(phenylmethoxymethylidene)-λ5-phosphane

C26H23OP — CID 14869671

IUPACtriphenyl(phenylmethoxymethylidene)-λ5-phosphane
SMILESC(OCc1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H23OP/c1-5-13-23(14-6-1)21-27-22-28(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,22H,21H2
InChIKeyZSWSZPQTTVQSCM-UHFFFAOYSA-N
MW382.44 g/mol
LogP4.96
Rot. Bonds6

About triphenyl(phenylmethoxymethylidene)-λ5-phosphane

triphenyl(phenylmethoxymethylidene)-λ5-phosphane (PubChem CID 14869671) has the molecular formula C26H23OP and a molecular weight of 382.44 g/mol. Its IUPAC name is triphenyl(phenylmethoxymethylidene)-λ5-phosphane.

Molecular Properties

Compound Nametriphenyl(phenylmethoxymethylidene)-λ5-phosphane
PubChem CID14869671
Molecular FormulaC26H23OP
Molecular Weight382.44 g/mol
Exact Mass382.15
IUPAC Nametriphenyl(phenylmethoxymethylidene)-λ5-phosphane
SMILESC(OCc1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H23OP/c1-5-13-23(14-6-1)21-27-22-28(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,22H,21H2
InChIKeyZSWSZPQTTVQSCM-UHFFFAOYSA-N
XLogP4.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 54.96
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

2-methoxyethoxymethylidene(triphenyl)-lambda5-phosphane
CID 15581400
ethenoxymethylbenzene
CID 11116115
benzyl methanimidate
CID 10176165
phenoxymethylidene(triphenyl)-λ5-phosphane
CID 21329537
ethane;ethenoxymethylbenzene
CID 144676673
2,2-difluoroethenoxymethylbenzene
CID 53483110
benzyl N-hydroxymethanimidate
CID 134694398
phenylmethoxymethylidenephosphane
CID 142882655
dimethyl(phenylmethoxymethylidene)azanium tetrafluoroborate
CID 13074146
2-dichlorophosphorylethenoxymethylbenzene
CID 71442996
[(E)-3-fluoroprop-1-enoxy]methylbenzene
CID 143459033
3-phenylmethoxyprop-2-enylsilane
CID 173015897

Frequently Asked Questions

What is the IUPAC name of triphenyl(phenylmethoxymethylidene)-λ5-phosphane?
The IUPAC name of triphenyl(phenylmethoxymethylidene)-λ5-phosphane (CID 14869671) is triphenyl(phenylmethoxymethylidene)-λ5-phosphane.
What is the SMILES notation for triphenyl(phenylmethoxymethylidene)-λ5-phosphane?
The canonical SMILES for triphenyl(phenylmethoxymethylidene)-λ5-phosphane is C(OCc1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of triphenyl(phenylmethoxymethylidene)-λ5-phosphane?
The InChIKey is ZSWSZPQTTVQSCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23OP/c1-5-13-23(14-6-1)21-27-22-28(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,22H,21H2.
What are the key properties of triphenyl(phenylmethoxymethylidene)-λ5-phosphane?
triphenyl(phenylmethoxymethylidene)-λ5-phosphane has a molecular weight of 382.44 g/mol, XLogP of 4.96, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl(phenylmethoxymethylidene)-λ5-phosphane is sourced from PubChem (CID 14869671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).