2,2-bis(3-methylphenyl)ethylphosphane

C16H19P — CID 175045111

IUPAC2,2-bis(3-methylphenyl)ethylphosphane
SMILESCc1cccc(C(CP)c2cccc(C)c2)c1
InChIInChI=1S/C16H19P/c1-12-5-3-7-14(9-12)16(11-17)15-8-4-6-13(2)10-15/h3-10,16H,11,17H2,1-2H3
InChIKeyBHLQPDVEOSXPAA-UHFFFAOYSA-N
MW242.30 g/mol
LogP4.31
Rot. Bonds3

About 2,2-bis(3-methylphenyl)ethylphosphane

2,2-bis(3-methylphenyl)ethylphosphane (PubChem CID 175045111) has the molecular formula C16H19P and a molecular weight of 242.30 g/mol. Its IUPAC name is 2,2-bis(3-methylphenyl)ethylphosphane.

Molecular Properties

Compound Name2,2-bis(3-methylphenyl)ethylphosphane
PubChem CID175045111
Molecular FormulaC16H19P
Molecular Weight242.30 g/mol
Exact Mass242.12
IUPAC Name2,2-bis(3-methylphenyl)ethylphosphane
SMILESCc1cccc(C(CP)c2cccc(C)c2)c1
InChIInChI=1S/C16H19P/c1-12-5-3-7-14(9-12)16(11-17)15-8-4-6-13(2)10-15/h3-10,16H,11,17H2,1-2H3
InChIKeyBHLQPDVEOSXPAA-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 54.31
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

1-methyl-3-[1,2,2-tris(3-methylphenyl)ethyl]benzene
CID 117071538
hydrogen peroxide;bis(1-methyl-3-propan-2-ylbenzene)
CID 172708535
benzene;ethane;1-methyl-3-propan-2-ylbenzene
CID 143383161
[1-(3-methylphenyl)-2-phosphanylethyl] thiocyanate
CID 175182236
2,2-bis(3-methylphenyl)ethylphosphonic acid
CID 118195001
ethane;1-methyl-3-propan-2-ylbenzene
CID 142020139
1-[fluoro(phenyl)methyl]-3-methylbenzene
CID 54364294
5-[4,4-bis(3-methylphenyl)butan-2-yl]-1,2,3-trimethylbenzene
CID 59091148
(3-methylphenyl)methanediamine;dihydrochloride
CID 67649251
CID 142381961
CID 142381961
2-(3-methylphenyl)propan-1-ol
CID 21478686
1-(3-methylphenyl)ethane-1,2-dithiol
CID 143743400

Frequently Asked Questions

What is the IUPAC name of 2,2-bis(3-methylphenyl)ethylphosphane?
The IUPAC name of 2,2-bis(3-methylphenyl)ethylphosphane (CID 175045111) is 2,2-bis(3-methylphenyl)ethylphosphane.
What is the SMILES notation for 2,2-bis(3-methylphenyl)ethylphosphane?
The canonical SMILES for 2,2-bis(3-methylphenyl)ethylphosphane is Cc1cccc(C(CP)c2cccc(C)c2)c1.
What is the InChIKey of 2,2-bis(3-methylphenyl)ethylphosphane?
The InChIKey is BHLQPDVEOSXPAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19P/c1-12-5-3-7-14(9-12)16(11-17)15-8-4-6-13(2)10-15/h3-10,16H,11,17H2,1-2H3.
What are the key properties of 2,2-bis(3-methylphenyl)ethylphosphane?
2,2-bis(3-methylphenyl)ethylphosphane has a molecular weight of 242.30 g/mol, XLogP of 4.31, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(3-methylphenyl)ethylphosphane is sourced from PubChem (CID 175045111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).