2-phenylethoxymethylidenetungsten

C9H10OW — CID 166530687

IUPAC2-phenylethoxymethylidenetungsten
SMILES[W]=COCCc1ccccc1
InChIInChI=1S/C9H10O.W/c1-10-8-7-9-5-3-2-4-6-9;/h1-6H,7-8H2;
InChIKeyKWNQLGFBRNCUSS-UHFFFAOYSA-N
MW318.02 g/mol
LogP1.55
Rot. Bonds4

About 2-phenylethoxymethylidenetungsten

2-phenylethoxymethylidenetungsten (PubChem CID 166530687) has the molecular formula C9H10OW and a molecular weight of 318.02 g/mol. Its IUPAC name is 2-phenylethoxymethylidenetungsten.

Molecular Properties

Compound Name2-phenylethoxymethylidenetungsten
PubChem CID166530687
Molecular FormulaC9H10OW
Molecular Weight318.02 g/mol
Exact Mass318.02
IUPAC Name2-phenylethoxymethylidenetungsten
SMILES[W]=COCCc1ccccc1
InChIInChI=1S/C9H10O.W/c1-10-8-7-9-5-3-2-4-6-9;/h1-6H,7-8H2;
InChIKeyKWNQLGFBRNCUSS-UHFFFAOYSA-N
XLogP1.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.02
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-phenylethoxymethylidenetungsten 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

CID 58731637
CID 58731637
2-(2-diethylphosphorylethenoxy)ethylbenzene
CID 71326502
2-(2-phenylethoxymethoxy)ethylbenzene
CID 14767491
2-methoxyethylbenzene
CID 19089
benzene;2-phenylethylbenzene
CID 18982764
(Z)-N-ethyl-N-methyl-2-(2-phenylethoxy)ethenamine
CID 153469242
hafnium;2-phenylethylbenzene
CID 173109801
CID 70626628
CID 70626628
2-phosphorosooxyethylbenzene
CID 23393054
dimethyl(2-phenylethoxy)phosphane
CID 141159269
CID 11412729
CID 11412729
18-phenyloctadecyl formate
CID 173425595

Frequently Asked Questions

What is the IUPAC name of 2-phenylethoxymethylidenetungsten?
The IUPAC name of 2-phenylethoxymethylidenetungsten (CID 166530687) is 2-phenylethoxymethylidenetungsten.
What is the SMILES notation for 2-phenylethoxymethylidenetungsten?
The canonical SMILES for 2-phenylethoxymethylidenetungsten is [W]=COCCc1ccccc1.
What is the InChIKey of 2-phenylethoxymethylidenetungsten?
The InChIKey is KWNQLGFBRNCUSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O.W/c1-10-8-7-9-5-3-2-4-6-9;/h1-6H,7-8H2;.
What are the key properties of 2-phenylethoxymethylidenetungsten?
2-phenylethoxymethylidenetungsten has a molecular weight of 318.02 g/mol, XLogP of 1.55, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylethoxymethylidenetungsten is sourced from PubChem (CID 166530687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).