methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride

C20H22ClOP — CID 173010059

IUPACmethoxy-methyl-triphenyl-λ5-phosphane;hydrochloride
SMILESCOP(C)(c1ccccc1)(c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C20H21OP.ClH/c1-21-22(2,18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;/h3-17H,1-2H3;1H
InChIKeyRWDYNSRSLDBPBF-UHFFFAOYSA-N
MW344.82 g/mol
LogP4.13
Rot. Bonds4

About methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride

methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride (PubChem CID 173010059) has the molecular formula C20H22ClOP and a molecular weight of 344.82 g/mol. Its IUPAC name is methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride.

Molecular Properties

Compound Namemethoxy-methyl-triphenyl-λ5-phosphane;hydrochloride
PubChem CID173010059
Molecular FormulaC20H22ClOP
Molecular Weight344.82 g/mol
Exact Mass344.11
IUPAC Namemethoxy-methyl-triphenyl-λ5-phosphane;hydrochloride
SMILESCOP(C)(c1ccccc1)(c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C20H21OP.ClH/c1-21-22(2,18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;/h3-17H,1-2H3;1H
InChIKeyRWDYNSRSLDBPBF-UHFFFAOYSA-N
XLogP4.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.82
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride?
The IUPAC name of methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride (CID 173010059) is methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride.
What is the SMILES notation for methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride?
The canonical SMILES for methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride is COP(C)(c1ccccc1)(c1ccccc1)c1ccccc1.Cl.
What is the InChIKey of methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride?
The InChIKey is RWDYNSRSLDBPBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21OP.ClH/c1-21-22(2,18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;/h3-17H,1-2H3;1H.
What are the key properties of methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride?
methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride has a molecular weight of 344.82 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-methyl-triphenyl-λ5-phosphane;hydrochloride is sourced from PubChem (CID 173010059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).