2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene

C23H21O3P — CID 10595674

IUPAC2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene
SMILESCOc1ccc2cc(P(C)(=O)c3ccc4cc(OC)ccc4c3)ccc2c1
InChIInChI=1S/C23H21O3P/c1-25-20-8-4-18-14-22(10-6-16(18)12-20)27(3,24)23-11-7-17-13-21(26-2)9-5-19(17)15-23/h4-15H,1-3H3
InChIKeyREKYPDOLILHFOR-UHFFFAOYSA-N
MW376.39 g/mol
LogP4.95
Rot. Bonds4

About 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene

2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene (PubChem CID 10595674) has the molecular formula C23H21O3P and a molecular weight of 376.39 g/mol. Its IUPAC name is 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene.

Molecular Properties

Compound Name2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene
PubChem CID10595674
Molecular FormulaC23H21O3P
Molecular Weight376.39 g/mol
Exact Mass376.12
IUPAC Name2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene
SMILESCOc1ccc2cc(P(C)(=O)c3ccc4cc(OC)ccc4c3)ccc2c1
InChIInChI=1S/C23H21O3P/c1-25-20-8-4-18-14-22(10-6-16(18)12-20)27(3,24)23-11-7-17-13-21(26-2)9-5-19(17)15-23/h4-15H,1-3H3
InChIKeyREKYPDOLILHFOR-UHFFFAOYSA-N
XLogP4.95
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.39
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(4-methoxyphenyl)-dioxido-oxo-λ5-phosphane
CID 7004098
7,20-dimethoxyhexacyclo[12.12.0.02,11.05,10.015,24.018,23]hexacosa-1(14),2(11),3,5(10),6,8,12,15(24),16,18(23),19,21,25-tridecaene
CID 58411039
2-methoxy-6-(4-methoxyphenyl)naphthalene
CID 11149734
6-methoxy-N-methylnaphthalen-2-amine
CID 20594775
iron;6-methoxynaphthalene-2-sulfonic acid
CID 87610362
4-methoxy-2-methyl-1-[methyl(phenyl)phosphoryl]benzene
CID 14790520
2-methoxy-6-[(2-methylpropan-2-yl)oxy]naphthalene
CID 155296690
7-methoxynaphthalene-2-sulfonyl chloride
CID 10515266
6-methoxyanthracene-1,4-dione
CID 70804223
5-methoxy-2H-isoindole
CID 122462019
2-hydroperoxy-7-methoxynaphthalene
CID 142950271
sodium 6-methoxynaphthalen-2-olate
CID 25112534

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene?
The IUPAC name of 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene (CID 10595674) is 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene.
What is the SMILES notation for 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene?
The canonical SMILES for 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene is COc1ccc2cc(P(C)(=O)c3ccc4cc(OC)ccc4c3)ccc2c1.
What is the InChIKey of 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene?
The InChIKey is REKYPDOLILHFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21O3P/c1-25-20-8-4-18-14-22(10-6-16(18)12-20)27(3,24)23-11-7-17-13-21(26-2)9-5-19(17)15-23/h4-15H,1-3H3.
What are the key properties of 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene?
2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene has a molecular weight of 376.39 g/mol, XLogP of 4.95, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-[(6-methoxynaphthalen-2-yl)-methylphosphoryl]naphthalene is sourced from PubChem (CID 10595674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).