cyclohexyl-bis(2-methoxyphenyl)phosphane

C20H25O2P — CID 101492497

IUPACcyclohexyl-bis(2-methoxyphenyl)phosphane
SMILESCOc1ccccc1P(c1ccccc1OC)C1CCCCC1
InChIInChI=1S/C20H25O2P/c1-21-17-12-6-8-14-19(17)23(16-10-4-3-5-11-16)20-15-9-7-13-18(20)22-2/h6-9,12-16H,3-5,10-11H2,1-2H3
InChIKeyFJCHOIBEADJCRG-UHFFFAOYSA-N
MW328.39 g/mol
LogP4.47
Rot. Bonds5

About cyclohexyl-bis(2-methoxyphenyl)phosphane

cyclohexyl-bis(2-methoxyphenyl)phosphane (PubChem CID 101492497) has the molecular formula C20H25O2P and a molecular weight of 328.39 g/mol. Its IUPAC name is cyclohexyl-bis(2-methoxyphenyl)phosphane.

Molecular Properties

Compound Namecyclohexyl-bis(2-methoxyphenyl)phosphane
PubChem CID101492497
Molecular FormulaC20H25O2P
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC Namecyclohexyl-bis(2-methoxyphenyl)phosphane
SMILESCOc1ccccc1P(c1ccccc1OC)C1CCCCC1
InChIInChI=1S/C20H25O2P/c1-21-17-12-6-8-14-19(17)23(16-10-4-3-5-11-16)20-15-9-7-13-18(20)22-2/h6-9,12-16H,3-5,10-11H2,1-2H3
InChIKeyFJCHOIBEADJCRG-UHFFFAOYSA-N
XLogP4.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-bis(2-methoxyphenyl)phosphane?
The IUPAC name of cyclohexyl-bis(2-methoxyphenyl)phosphane (CID 101492497) is cyclohexyl-bis(2-methoxyphenyl)phosphane.
What is the SMILES notation for cyclohexyl-bis(2-methoxyphenyl)phosphane?
The canonical SMILES for cyclohexyl-bis(2-methoxyphenyl)phosphane is COc1ccccc1P(c1ccccc1OC)C1CCCCC1.
What is the InChIKey of cyclohexyl-bis(2-methoxyphenyl)phosphane?
The InChIKey is FJCHOIBEADJCRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25O2P/c1-21-17-12-6-8-14-19(17)23(16-10-4-3-5-11-16)20-15-9-7-13-18(20)22-2/h6-9,12-16H,3-5,10-11H2,1-2H3.
What are the key properties of cyclohexyl-bis(2-methoxyphenyl)phosphane?
cyclohexyl-bis(2-methoxyphenyl)phosphane has a molecular weight of 328.39 g/mol, XLogP of 4.47, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-bis(2-methoxyphenyl)phosphane is sourced from PubChem (CID 101492497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).