[1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane

C42H41P — CID 164669483

IUPAC[1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane
SMILESCCCC/C=C(\CCCC)c1ccc2ccccc2c1-c1c(P(c2ccccc2)c2ccccc2)ccc2ccccc12
InChIInChI=1S/C42H41P/c1-3-5-9-19-32(18-6-4-2)39-30-28-33-20-14-16-26-37(33)41(39)42-38-27-17-15-21-34(38)29-31-40(42)43(35-22-10-7-11-23-35)36-24-12-8-13-25-36/h7-8,10-17,19-31H,3-6,9,18H2,1-2H3/b32-19+
InChIKeyHBEYKODWWBLCDL-BIZUNTBRSA-N
MW576.76 g/mol
LogP11.18
Rot. Bonds11

About [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane

[1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane (PubChem CID 164669483) has the molecular formula C42H41P and a molecular weight of 576.76 g/mol. Its IUPAC name is [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane.

Molecular Properties

Compound Name[1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane
PubChem CID164669483
Molecular FormulaC42H41P
Molecular Weight576.76 g/mol
Exact Mass576.29
IUPAC Name[1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane
SMILESCCCC/C=C(\CCCC)c1ccc2ccccc2c1-c1c(P(c2ccccc2)c2ccccc2)ccc2ccccc12
InChIInChI=1S/C42H41P/c1-3-5-9-19-32(18-6-4-2)39-30-28-33-20-14-16-26-37(33)41(39)42-38-27-17-15-21-34(38)29-31-40(42)43(35-22-10-7-11-23-35)36-24-12-8-13-25-36/h7-8,10-17,19-31H,3-6,9,18H2,1-2H3/b32-19+
InChIKeyHBEYKODWWBLCDL-BIZUNTBRSA-N
XLogP11.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500576.76
LogP ≤ 511.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-[2-[(E)-hex-3-en-3-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane
CID 164669467
1-[(E)-dec-5-en-5-yl]naphthalene
CID 14452097
diphenyl-[1-(2-trihexylsilylnaphthalen-1-yl)naphthalen-2-yl]phosphane
CID 170896910
bis([1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane);bis(rhodium);dihydrate
CID 73162021
[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;ruthenium(1+);acetate
CID 21202945
[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane
CID 21335175
[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-methyl-phenylphosphane
CID 11981183
carbon monoxide;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;rhodium
CID 139254479
diethylazanide;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;ruthenium(2+);chloride
CID 54759317
diphenyl-[1-(2-phosphanylnaphthalen-1-yl)naphthalen-2-yl]phosphane
CID 59732549
4-[[1-[2-bis(4-hydroxyphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-(4-hydroxyphenyl)phosphanyl]phenol
CID 102082604
(1R,2R)-1,2-diphenylethane-1,2-diamine;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;ruthenium(6+);dichloride
CID 25029251

Frequently Asked Questions

What is the IUPAC name of [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane?
The IUPAC name of [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane (CID 164669483) is [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane.
What is the SMILES notation for [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane?
The canonical SMILES for [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane is CCCC/C=C(\CCCC)c1ccc2ccccc2c1-c1c(P(c2ccccc2)c2ccccc2)ccc2ccccc12.
What is the InChIKey of [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane?
The InChIKey is HBEYKODWWBLCDL-BIZUNTBRSA-N. The full InChI is InChI=1S/C42H41P/c1-3-5-9-19-32(18-6-4-2)39-30-28-33-20-14-16-26-37(33)41(39)42-38-27-17-15-21-34(38)29-31-40(42)43(35-22-10-7-11-23-35)36-24-12-8-13-25-36/h7-8,10-17,19-31H,3-6,9,18H2,1-2H3/b32-19+.
What are the key properties of [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane?
[1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane has a molecular weight of 576.76 g/mol, XLogP of 11.18, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-[(E)-dec-5-en-5-yl]naphthalen-1-yl]naphthalen-2-yl]-diphenylphosphane is sourced from PubChem (CID 164669483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).