phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane

C34H28P2 — CID 21335479

IUPACphenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane
SMILESc1ccc(PCc2ccc3ccccc3c2-c2c(CPc3ccccc3)ccc3ccccc23)cc1
InChIInChI=1S/C34H28P2/c1-3-13-29(14-4-1)35-23-27-21-19-25-11-7-9-17-31(25)33(27)34-28(24-36-30-15-5-2-6-16-30)22-20-26-12-8-10-18-32(26)34/h1-22,35-36H,23-24H2
InChIKeyLADCMHILCGFIMS-UHFFFAOYSA-N
MW498.55 g/mol
LogP8.67
Rot. Bonds7

About phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane

phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane (PubChem CID 21335479) has the molecular formula C34H28P2 and a molecular weight of 498.55 g/mol. Its IUPAC name is phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane.

Molecular Properties

Compound Namephenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane
PubChem CID21335479
Molecular FormulaC34H28P2
Molecular Weight498.55 g/mol
Exact Mass498.17
IUPAC Namephenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane
SMILESc1ccc(PCc2ccc3ccccc3c2-c2c(CPc3ccccc3)ccc3ccccc23)cc1
InChIInChI=1S/C34H28P2/c1-3-13-29(14-4-1)35-23-27-21-19-25-11-7-9-17-31(25)33(27)34-28(24-36-30-15-5-2-6-16-30)22-20-26-12-8-10-18-32(26)34/h1-22,35-36H,23-24H2
InChIKeyLADCMHILCGFIMS-UHFFFAOYSA-N
XLogP8.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500498.55
LogP ≤ 58.67
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

ethane;phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane
CID 159820370
2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene
CID 59336410
2-butyl-1-(2-butylnaphthalen-1-yl)naphthalene
CID 59129933
2-[1-[2-(2-hydroxyethyl)naphthalen-1-yl]naphthalen-2-yl]ethanol
CID 10405122
1-phenyl-2-propylnaphthalene
CID 102463751
2-(diphenylphosphorylmethyl)-1-[2-(diphenylphosphorylmethyl)naphthalen-1-yl]naphthalene
CID 10952532
nonacyclo[30.8.0.02,11.03,8.012,21.015,20.022,31.023,28.035,40]tetraconta-1(32),2(11),3,5,7,9,12(21),13,15,17,19,22(31),23,25,27,29,33,35,37,39-icosaene
CID 15525083
1-(2-aminonaphthalen-1-yl)naphthalen-2-amine;hydrochloride
CID 139641730
[1-[2-(dinaphthalen-1-ylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl-dinaphthalen-1-ylphosphane
CID 100943233
[1-(2-ethylnaphthalen-1-yl)naphthalen-2-yl]methyl-diphenylphosphane
CID 159069423
phenanthrene;sulfane
CID 159172584
phenanthrene;phosphane
CID 161431298

Frequently Asked Questions

What is the IUPAC name of phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane?
The IUPAC name of phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane (CID 21335479) is phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane.
What is the SMILES notation for phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane?
The canonical SMILES for phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane is c1ccc(PCc2ccc3ccccc3c2-c2c(CPc3ccccc3)ccc3ccccc23)cc1.
What is the InChIKey of phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane?
The InChIKey is LADCMHILCGFIMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28P2/c1-3-13-29(14-4-1)35-23-27-21-19-25-11-7-9-17-31(25)33(27)34-28(24-36-30-15-5-2-6-16-30)22-20-26-12-8-10-18-32(26)34/h1-22,35-36H,23-24H2.
What are the key properties of phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane?
phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane has a molecular weight of 498.55 g/mol, XLogP of 8.67, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[[1-[2-(phenylphosphanylmethyl)naphthalen-1-yl]naphthalen-2-yl]methyl]phosphane is sourced from PubChem (CID 21335479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).