sodium;diphenylmethylbenzene;ethoxyethane

C23H25NaO — CID 174702547

IUPACsodium;diphenylmethylbenzene;ethoxyethane
SMILESCCOCC.[Na+].c1ccc([C-](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H15.C4H10O.Na/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-5-4-2;/h1-15H;3-4H2,1-2H3;/q-1;;+1
InChIKeyXNKOONDHTKNKJP-UHFFFAOYSA-N
MW340.44 g/mol
LogP2.75
Rot. Bonds5

About sodium;diphenylmethylbenzene;ethoxyethane

sodium;diphenylmethylbenzene;ethoxyethane (PubChem CID 174702547) has the molecular formula C23H25NaO and a molecular weight of 340.44 g/mol. Its IUPAC name is sodium;diphenylmethylbenzene;ethoxyethane.

Molecular Properties

Compound Namesodium;diphenylmethylbenzene;ethoxyethane
PubChem CID174702547
Molecular FormulaC23H25NaO
Molecular Weight340.44 g/mol
Exact Mass340.18
IUPAC Namesodium;diphenylmethylbenzene;ethoxyethane
SMILESCCOCC.[Na+].c1ccc([C-](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H15.C4H10O.Na/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-5-4-2;/h1-15H;3-4H2,1-2H3;/q-1;;+1
InChIKeyXNKOONDHTKNKJP-UHFFFAOYSA-N
XLogP2.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.44
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

benzylbenzene;ethoxyethane
CID 69148831
1,1'-biphenyl;ethene;ethoxyethane
CID 155168221
ethoxybenzene;ethoxyethane
CID 67764259
1,1'-biphenyl;ethanol;ethoxyethane
CID 70401504
1,2-dichlorobenzene;ethoxyethane
CID 68845412
magnesium;bromobenzene;ethoxyethane;hydride
CID 173158807
1,2-diphenylethane-1,2-dione;ethoxyethane
CID 67496620
disodium;ethoxyethane
CID 23107014
ethoxyethane;pentahydrate
CID 141041283
ethoxyethane;hydrate
CID 22594236
ethoxyethane;1-phenylethenylbenzene
CID 69353422
ethoxyethane;triphenylmethanol
CID 70428584

Frequently Asked Questions

What is the IUPAC name of sodium;diphenylmethylbenzene;ethoxyethane?
The IUPAC name of sodium;diphenylmethylbenzene;ethoxyethane (CID 174702547) is sodium;diphenylmethylbenzene;ethoxyethane.
What is the SMILES notation for sodium;diphenylmethylbenzene;ethoxyethane?
The canonical SMILES for sodium;diphenylmethylbenzene;ethoxyethane is CCOCC.[Na+].c1ccc([C-](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of sodium;diphenylmethylbenzene;ethoxyethane?
The InChIKey is XNKOONDHTKNKJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15.C4H10O.Na/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-5-4-2;/h1-15H;3-4H2,1-2H3;/q-1;;+1.
What are the key properties of sodium;diphenylmethylbenzene;ethoxyethane?
sodium;diphenylmethylbenzene;ethoxyethane has a molecular weight of 340.44 g/mol, XLogP of 2.75, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;diphenylmethylbenzene;ethoxyethane is sourced from PubChem (CID 174702547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).