(2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane

C24H32P2 — CID 58886856

IUPAC(2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane
SMILESc1ccc(C[C@H]2CCCP2CCP2CCC[C@@H]2Cc2ccccc2)cc1
InChIInChI=1S/C24H32P2/c1-3-9-21(10-4-1)19-23-13-7-15-25(23)17-18-26-16-8-14-24(26)20-22-11-5-2-6-12-22/h1-6,9-12,23-24H,7-8,13-20H2/t23-,24-,25?,26?/m1/s1
InChIKeyJCSVASIPAWNUGF-TYPLQMOASA-N
MW382.47 g/mol
LogP6.76
Rot. Bonds7

About (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane

(2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane (PubChem CID 58886856) has the molecular formula C24H32P2 and a molecular weight of 382.47 g/mol. Its IUPAC name is (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane.

Molecular Properties

Compound Name(2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane
PubChem CID58886856
Molecular FormulaC24H32P2
Molecular Weight382.47 g/mol
Exact Mass382.20
IUPAC Name(2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane
SMILESc1ccc(C[C@H]2CCCP2CCP2CCC[C@@H]2Cc2ccccc2)cc1
InChIInChI=1S/C24H32P2/c1-3-9-21(10-4-1)19-23-13-7-15-25(23)17-18-26-16-8-14-24(26)20-22-11-5-2-6-12-22/h1-6,9-12,23-24H,7-8,13-20H2/t23-,24-,25?,26?/m1/s1
InChIKeyJCSVASIPAWNUGF-TYPLQMOASA-N
XLogP6.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.47
LogP ≤ 56.76
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

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane?
The IUPAC name of (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane (CID 58886856) is (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane.
What is the SMILES notation for (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane?
The canonical SMILES for (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane is c1ccc(C[C@H]2CCCP2CCP2CCC[C@@H]2Cc2ccccc2)cc1.
What is the InChIKey of (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane?
The InChIKey is JCSVASIPAWNUGF-TYPLQMOASA-N. The full InChI is InChI=1S/C24H32P2/c1-3-9-21(10-4-1)19-23-13-7-15-25(23)17-18-26-16-8-14-24(26)20-22-11-5-2-6-12-22/h1-6,9-12,23-24H,7-8,13-20H2/t23-,24-,25?,26?/m1/s1.
What are the key properties of (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane?
(2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane has a molecular weight of 382.47 g/mol, XLogP of 6.76, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-benzyl-1-[2-[(2R)-2-benzylphospholan-1-yl]ethyl]phospholane is sourced from PubChem (CID 58886856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).