4-(5-methyl-2-phosphanylphenyl)phenol

C13H13OP — CID 142980688

IUPAC4-(5-methyl-2-phosphanylphenyl)phenol
SMILESCc1ccc(P)c(-c2ccc(O)cc2)c1
InChIInChI=1S/C13H13OP/c1-9-2-7-13(15)12(8-9)10-3-5-11(14)6-4-10/h2-8,14H,15H2,1H3
InChIKeyWNJSLKMLIQJTSV-UHFFFAOYSA-N
MW216.22 g/mol
LogP2.87
Rot. Bonds1

About 4-(5-methyl-2-phosphanylphenyl)phenol

4-(5-methyl-2-phosphanylphenyl)phenol (PubChem CID 142980688) has the molecular formula C13H13OP and a molecular weight of 216.22 g/mol. Its IUPAC name is 4-(5-methyl-2-phosphanylphenyl)phenol.

Molecular Properties

Compound Name4-(5-methyl-2-phosphanylphenyl)phenol
PubChem CID142980688
Molecular FormulaC13H13OP
Molecular Weight216.22 g/mol
Exact Mass216.07
IUPAC Name4-(5-methyl-2-phosphanylphenyl)phenol
SMILESCc1ccc(P)c(-c2ccc(O)cc2)c1
InChIInChI=1S/C13H13OP/c1-9-2-7-13(15)12(8-9)10-3-5-11(14)6-4-10/h2-8,14H,15H2,1H3
InChIKeyWNJSLKMLIQJTSV-UHFFFAOYSA-N
XLogP2.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.22
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-[2-[[2-(4-hydroxyphenyl)-4-methylphenyl]methyl]-5-methylphenyl]phenol
CID 174190605
hydrogen peroxide;2-(2-hydroxy-5-methylphenyl)-4-methylphenol;4-methylphenol
CID 159043640
4-methylphenol
CID 70549076
4-(2-bromo-4-methylphenyl)phenol
CID 175328096
ethane;4-(4-methylphenyl)phenol
CID 161379556
bis(4-methylphenol);tetrahydrochloride
CID 175346853
4-methylphenol;hydrate
CID 71777661
chromium;bis(4-methylphenol);chloride
CID 172752271
4-methylphenol;propan-2-ylphosphane
CID 144779899
2,5-dimethylphenol;4-methylphenol
CID 67649093
4-methylphenol;2-methylpropane
CID 91606636
boric acid;4-methylphenol
CID 67912006

Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-2-phosphanylphenyl)phenol?
The IUPAC name of 4-(5-methyl-2-phosphanylphenyl)phenol (CID 142980688) is 4-(5-methyl-2-phosphanylphenyl)phenol.
What is the SMILES notation for 4-(5-methyl-2-phosphanylphenyl)phenol?
The canonical SMILES for 4-(5-methyl-2-phosphanylphenyl)phenol is Cc1ccc(P)c(-c2ccc(O)cc2)c1.
What is the InChIKey of 4-(5-methyl-2-phosphanylphenyl)phenol?
The InChIKey is WNJSLKMLIQJTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13OP/c1-9-2-7-13(15)12(8-9)10-3-5-11(14)6-4-10/h2-8,14H,15H2,1H3.
What are the key properties of 4-(5-methyl-2-phosphanylphenyl)phenol?
4-(5-methyl-2-phosphanylphenyl)phenol has a molecular weight of 216.22 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-2-phosphanylphenyl)phenol is sourced from PubChem (CID 142980688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).