bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane

C30H48P2 — CID 57295822

IUPACbis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane
SMILESC1CC2(P(CCP(C34CCC(CC3)C4)C34CCC(CC3)C4)C34CCC(CC3)C4)CCC1C2
InChIInChI=1S/C30H48P2/c1-9-27(10-2-23(1)19-27)31(28-11-3-24(20-28)4-12-28)17-18-32(29-13-5-25(21-29)6-14-29)30-15-7-26(22-30)8-16-30/h23-26H,1-22H2
InChIKeyOJBUXGDSOCUZGO-UHFFFAOYSA-N
MW470.66 g/mol
LogP9.28
Rot. Bonds7

About bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane

bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane (PubChem CID 57295822) has the molecular formula C30H48P2 and a molecular weight of 470.66 g/mol. Its IUPAC name is bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane.

Molecular Properties

Compound Namebis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane
PubChem CID57295822
Molecular FormulaC30H48P2
Molecular Weight470.66 g/mol
Exact Mass470.32
IUPAC Namebis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane
SMILESC1CC2(P(CCP(C34CCC(CC3)C4)C34CCC(CC3)C4)C34CCC(CC3)C4)CCC1C2
InChIInChI=1S/C30H48P2/c1-9-27(10-2-23(1)19-27)31(28-11-3-24(20-28)4-12-28)17-18-32(29-13-5-25(21-29)6-14-29)30-15-7-26(22-30)8-16-30/h23-26H,1-22H2
InChIKeyOJBUXGDSOCUZGO-UHFFFAOYSA-N
XLogP9.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.66
LogP ≤ 59.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane 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-bicyclo[2.2.1]heptanyl(dichloro)phosphane
CID 87246148
1-bicyclo[2.2.1]heptanyl(dihexyl)phosphane
CID 23105437
bis(1-adamantyl)-butylphosphane;hydrobromide
CID 153370159
bicyclo[2.2.2]octan-1-amine
CID 550214
bicyclo[2.2.1]heptan-1-ol
CID 524266
bis(1-bicyclo[2.2.1]heptanyl)phosphanyl-tert-butyl-diphenylphosphanium
CID 87977173
ethane;1-ethylbicyclo[2.2.1]heptane
CID 168937878
ethane;1-methylbicyclo[2.2.1]heptane
CID 164557496
3-(1-bicyclo[2.2.1]heptanyl)propanoic acid
CID 70398631
bicyclo[2.2.1]heptane-1-carbonyl bromide
CID 21489193
(1-amino-3-bicyclo[3.2.1]octanyl)-trimethylazanium
CID 69301855
bicyclo[2.2.1]heptane-1-carbonitrile
CID 517818

Frequently Asked Questions

What is the IUPAC name of bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane?
The IUPAC name of bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane (CID 57295822) is bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane.
What is the SMILES notation for bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane?
The canonical SMILES for bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane is C1CC2(P(CCP(C34CCC(CC3)C4)C34CCC(CC3)C4)C34CCC(CC3)C4)CCC1C2.
What is the InChIKey of bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane?
The InChIKey is OJBUXGDSOCUZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H48P2/c1-9-27(10-2-23(1)19-27)31(28-11-3-24(20-28)4-12-28)17-18-32(29-13-5-25(21-29)6-14-29)30-15-7-26(22-30)8-16-30/h23-26H,1-22H2.
What are the key properties of bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane?
bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane has a molecular weight of 470.66 g/mol, XLogP of 9.28, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-bicyclo[2.2.1]heptanyl)-[2-[bis(1-bicyclo[2.2.1]heptanyl)phosphanyl]ethyl]phosphane is sourced from PubChem (CID 57295822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).