methyl-(2-methylphenyl)-triphenyl-λ5-phosphane

C26H25P — CID 173273216

IUPACmethyl-(2-methylphenyl)-triphenyl-λ5-phosphane
SMILESCc1ccccc1P(C)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H25P/c1-22-14-12-13-21-26(22)27(2,23-15-6-3-7-16-23,24-17-8-4-9-18-24)25-19-10-5-11-20-25/h3-21H,1-2H3
InChIKeyGFTGYVOCZDCUNF-UHFFFAOYSA-N
MW368.46 g/mol
LogP4.78
Rot. Bonds4

About methyl-(2-methylphenyl)-triphenyl-λ5-phosphane

methyl-(2-methylphenyl)-triphenyl-λ5-phosphane (PubChem CID 173273216) has the molecular formula C26H25P and a molecular weight of 368.46 g/mol. Its IUPAC name is methyl-(2-methylphenyl)-triphenyl-λ5-phosphane.

Molecular Properties

Compound Namemethyl-(2-methylphenyl)-triphenyl-λ5-phosphane
PubChem CID173273216
Molecular FormulaC26H25P
Molecular Weight368.46 g/mol
Exact Mass368.17
IUPAC Namemethyl-(2-methylphenyl)-triphenyl-λ5-phosphane
SMILESCc1ccccc1P(C)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H25P/c1-22-14-12-13-21-26(22)27(2,23-15-6-3-7-16-23,24-17-8-4-9-18-24)25-19-10-5-11-20-25/h3-21H,1-2H3
InChIKeyGFTGYVOCZDCUNF-UHFFFAOYSA-N
XLogP4.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

CID 174395890
CID 174395890
bromo-tris(2-methylphenyl)-phenyl-λ5-phosphane
CID 139776623
difluoro-bis(2-methylphenyl)-phenyl-lambda5-phosphane
CID 15182989
benzene;1,2-xylene
CID 161464493
dichloro-tris(2-methylphenyl)-λ5-phosphane;palladium
CID 174858130
bromo-methyl-triphenyl-λ5-phosphane;hydrobromide
CID 173269490
1,2-xylene
CID 173422016
CID 71339905
CID 71339905
difluoro-methyl-diphenyl-λ5-phosphane
CID 6421241
2-bromo-4-methoxy-6-[methyl(triphenyl)-λ5-phosphanyl]phenol
CID 173329205
1,2-xylene;trihydrochloride
CID 70594732
1,2-xylene;zirconium
CID 174354618

Frequently Asked Questions

What is the IUPAC name of methyl-(2-methylphenyl)-triphenyl-λ5-phosphane?
The IUPAC name of methyl-(2-methylphenyl)-triphenyl-λ5-phosphane (CID 173273216) is methyl-(2-methylphenyl)-triphenyl-λ5-phosphane.
What is the SMILES notation for methyl-(2-methylphenyl)-triphenyl-λ5-phosphane?
The canonical SMILES for methyl-(2-methylphenyl)-triphenyl-λ5-phosphane is Cc1ccccc1P(C)(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of methyl-(2-methylphenyl)-triphenyl-λ5-phosphane?
The InChIKey is GFTGYVOCZDCUNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25P/c1-22-14-12-13-21-26(22)27(2,23-15-6-3-7-16-23,24-17-8-4-9-18-24)25-19-10-5-11-20-25/h3-21H,1-2H3.
What are the key properties of methyl-(2-methylphenyl)-triphenyl-λ5-phosphane?
methyl-(2-methylphenyl)-triphenyl-λ5-phosphane has a molecular weight of 368.46 g/mol, XLogP of 4.78, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-(2-methylphenyl)-triphenyl-λ5-phosphane is sourced from PubChem (CID 173273216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).