ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane

C27H28P2 — CID 158097838

IUPACethyl(diphenyl)phosphane;methyl(diphenyl)phosphane
SMILESCCP(c1ccccc1)c1ccccc1.CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H15P.C13H13P/c1-2-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14;1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h3-12H,2H2,1H3;2-11H,1H3
InChIKeyFOWOWUVUHGDWAS-UHFFFAOYSA-N
MW414.47 g/mol
LogP5.89
Rot. Bonds5

About ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane

ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane (PubChem CID 158097838) has the molecular formula C27H28P2 and a molecular weight of 414.47 g/mol. Its IUPAC name is ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane.

Molecular Properties

Compound Nameethyl(diphenyl)phosphane;methyl(diphenyl)phosphane
PubChem CID158097838
Molecular FormulaC27H28P2
Molecular Weight414.47 g/mol
Exact Mass414.17
IUPAC Nameethyl(diphenyl)phosphane;methyl(diphenyl)phosphane
SMILESCCP(c1ccccc1)c1ccccc1.CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H15P.C13H13P/c1-2-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14;1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h3-12H,2H2,1H3;2-11H,1H3
InChIKeyFOWOWUVUHGDWAS-UHFFFAOYSA-N
XLogP5.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.47
LogP ≤ 55.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

borane;methyl(diphenyl)phosphane
CID 13485169
ethyl(diphenyl)phosphane;trichlororuthenium
CID 159343437
methyl(diphenyl)phosphane;palladium(2+);dichloride
CID 175235701
carbanide;gold(1+);methyl(diphenyl)phosphane
CID 87994939
ethyl-phenyl-(4-phenylphenyl)phosphane
CID 21301209
CID 164679845
CID 164679845
dichlororuthenium;bis(methyl(diphenyl)phosphane)
CID 175433637
CID 18612341
CID 18612341
ethyl(diphenyl)phosphane;triethoxysilane
CID 161086749
gold(1+);methyl(diphenyl)phosphane;trifluoromethane
CID 134981383
(S)-ethyl-methyl-phenylphosphane
CID 10909914
[2-(diphenylphosphanylmethyl)-2-ethylbutyl]-diphenylphosphane
CID 22052782

Frequently Asked Questions

What is the IUPAC name of ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane?
The IUPAC name of ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane (CID 158097838) is ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane.
What is the SMILES notation for ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane?
The canonical SMILES for ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane is CCP(c1ccccc1)c1ccccc1.CP(c1ccccc1)c1ccccc1.
What is the InChIKey of ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane?
The InChIKey is FOWOWUVUHGDWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15P.C13H13P/c1-2-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14;1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h3-12H,2H2,1H3;2-11H,1H3.
What are the key properties of ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane?
ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane has a molecular weight of 414.47 g/mol, XLogP of 5.89, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane is sourced from PubChem (CID 158097838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).