[2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane

C14H16OP2 — CID 70841120

IUPAC[2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane
SMILESCOCc1cccc(P)c1-c1ccccc1P
InChIInChI=1S/C14H16OP2/c1-15-9-10-5-4-8-13(17)14(10)11-6-2-3-7-12(11)16/h2-8H,9,16-17H2,1H3
InChIKeyTUNFPWACDQWXCP-UHFFFAOYSA-N
MW262.23 g/mol
LogP2.50
Rot. Bonds3

About [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane

[2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane (PubChem CID 70841120) has the molecular formula C14H16OP2 and a molecular weight of 262.23 g/mol. Its IUPAC name is [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane.

Molecular Properties

Compound Name[2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane
PubChem CID70841120
Molecular FormulaC14H16OP2
Molecular Weight262.23 g/mol
Exact Mass262.07
IUPAC Name[2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane
SMILESCOCc1cccc(P)c1-c1ccccc1P
InChIInChI=1S/C14H16OP2/c1-15-9-10-5-4-8-13(17)14(10)11-6-2-3-7-12(11)16/h2-8H,9,16-17H2,1H3
InChIKeyTUNFPWACDQWXCP-UHFFFAOYSA-N
XLogP2.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane?
The IUPAC name of [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane (CID 70841120) is [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane.
What is the SMILES notation for [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane?
The canonical SMILES for [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane is COCc1cccc(P)c1-c1ccccc1P.
What is the InChIKey of [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane?
The InChIKey is TUNFPWACDQWXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16OP2/c1-15-9-10-5-4-8-13(17)14(10)11-6-2-3-7-12(11)16/h2-8H,9,16-17H2,1H3.
What are the key properties of [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane?
[2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane has a molecular weight of 262.23 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(methoxymethyl)-6-phosphanylphenyl]phenyl]phosphane is sourced from PubChem (CID 70841120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).