[2-ethoxyethyl(phenyl)phosphoryl]benzene

C16H19O2P — CID 2304634

IUPAC[2-ethoxyethyl(phenyl)phosphoryl]benzene
SMILESCCOCCP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H19O2P/c1-2-18-13-14-19(17,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3
InChIKeyDJHRULHYHZYVCO-UHFFFAOYSA-N
MW274.30 g/mol
LogP3.04
Rot. Bonds6

About [2-ethoxyethyl(phenyl)phosphoryl]benzene

[2-ethoxyethyl(phenyl)phosphoryl]benzene (PubChem CID 2304634) has the molecular formula C16H19O2P and a molecular weight of 274.30 g/mol. Its IUPAC name is [2-ethoxyethyl(phenyl)phosphoryl]benzene.

Molecular Properties

Compound Name[2-ethoxyethyl(phenyl)phosphoryl]benzene
PubChem CID2304634
Molecular FormulaC16H19O2P
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name[2-ethoxyethyl(phenyl)phosphoryl]benzene
SMILESCCOCCP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H19O2P/c1-2-18-13-14-19(17,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3
InChIKeyDJHRULHYHZYVCO-UHFFFAOYSA-N
XLogP3.04
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [2-ethoxyethyl(phenyl)phosphoryl]benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-diphenylphosphorylethyl(ethoxy)phosphinic acid
CID 102209255
[6-methoxyhexyl(phenyl)phosphoryl]benzene
CID 141463056
[2-dimethoxyphosphorylethyl(phenyl)phosphoryl]benzene
CID 15362204
[2-methoxyethoxymethyl(phenyl)phosphoryl]benzene
CID 4116161
25,26,27,28-tetrakis(2-diphenylphosphorylethoxy)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15,17,19(26),21,23-dodecaene
CID 100934557
2-diphenylphosphorylethyl-dimethoxy-methylsilane
CID 13356480
diphenylphosphane;diphenylphosphorylbenzene;ethoxyethane
CID 174371985
[diphenylphosphorylmethyl(phenyl)phosphoryl]benzene;terbium(3+)
CID 170659309
1-[butyl(phenyl)phosphoryl]-4-chlorobenzene
CID 134968040
2-ethoxyethyl-(4-methylphenyl)phosphinic acid
CID 118860001
1,3-bis[ethyl(phenyl)phosphoryl]benzene
CID 59816903
dipropoxyphosphorylbenzene
CID 11736632

Frequently Asked Questions

What is the IUPAC name of [2-ethoxyethyl(phenyl)phosphoryl]benzene?
The IUPAC name of [2-ethoxyethyl(phenyl)phosphoryl]benzene (CID 2304634) is [2-ethoxyethyl(phenyl)phosphoryl]benzene.
What is the SMILES notation for [2-ethoxyethyl(phenyl)phosphoryl]benzene?
The canonical SMILES for [2-ethoxyethyl(phenyl)phosphoryl]benzene is CCOCCP(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of [2-ethoxyethyl(phenyl)phosphoryl]benzene?
The InChIKey is DJHRULHYHZYVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19O2P/c1-2-18-13-14-19(17,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3.
What are the key properties of [2-ethoxyethyl(phenyl)phosphoryl]benzene?
[2-ethoxyethyl(phenyl)phosphoryl]benzene has a molecular weight of 274.30 g/mol, XLogP of 3.04, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethoxyethyl(phenyl)phosphoryl]benzene is sourced from PubChem (CID 2304634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).