(2,3,4-triphenylphenyl)sulfanylmethylphosphane

C25H21PS — CID 23186709

IUPAC(2,3,4-triphenylphenyl)sulfanylmethylphosphane
SMILESPCSc1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C25H21PS/c26-18-27-23-17-16-22(19-10-4-1-5-11-19)24(20-12-6-2-7-13-20)25(23)21-14-8-3-9-15-21/h1-17H,18,26H2
InChIKeyHNYKNWYPPRGUTJ-UHFFFAOYSA-N
MW384.48 g/mol
LogP7.61
Rot. Bonds5

About (2,3,4-triphenylphenyl)sulfanylmethylphosphane

(2,3,4-triphenylphenyl)sulfanylmethylphosphane (PubChem CID 23186709) has the molecular formula C25H21PS and a molecular weight of 384.48 g/mol. Its IUPAC name is (2,3,4-triphenylphenyl)sulfanylmethylphosphane.

Molecular Properties

Compound Name(2,3,4-triphenylphenyl)sulfanylmethylphosphane
PubChem CID23186709
Molecular FormulaC25H21PS
Molecular Weight384.48 g/mol
Exact Mass384.11
IUPAC Name(2,3,4-triphenylphenyl)sulfanylmethylphosphane
SMILESPCSc1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C25H21PS/c26-18-27-23-17-16-22(19-10-4-1-5-11-19)24(20-12-6-2-7-13-20)25(23)21-14-8-3-9-15-21/h1-17H,18,26H2
InChIKeyHNYKNWYPPRGUTJ-UHFFFAOYSA-N
XLogP7.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 57.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ruthenium;(2,3,4-triphenylphenyl)phosphane
CID 161293596
1,4-bis(4-methylphenyl)-2,3-diphenylbenzene
CID 123305097
1,2,3,4-tetraphenylbenzene;triazine
CID 175536377
3-[3,4-diphenyl-2-[4-(2,3,6-triphenylphenyl)phenyl]phenyl]benzenethiol
CID 70842936
1-(bromomethyl)-2,3,4-triphenylbenzene;phosphane
CID 87586907
1,2-diphenylnaphthalene
CID 11208267
1-(2,2-diphenylethyl)-2,3-diphenylbenzene
CID 173154166
2-phenyl-1-(2-phenylazulen-1-yl)azulene
CID 177444827
1,2,3-triphenyl-4-(trichloromethyl)benzene
CID 57019840
(2,3,4-triphenylphenyl)hydrazine
CID 67058028
(2,3-diphenylphenyl) thiohypofluorite
CID 151424182
1-cyclohexa-1,5-dien-1-yl-2,3,4-triphenylbenzene
CID 174079697

Frequently Asked Questions

What is the IUPAC name of (2,3,4-triphenylphenyl)sulfanylmethylphosphane?
The IUPAC name of (2,3,4-triphenylphenyl)sulfanylmethylphosphane (CID 23186709) is (2,3,4-triphenylphenyl)sulfanylmethylphosphane.
What is the SMILES notation for (2,3,4-triphenylphenyl)sulfanylmethylphosphane?
The canonical SMILES for (2,3,4-triphenylphenyl)sulfanylmethylphosphane is PCSc1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of (2,3,4-triphenylphenyl)sulfanylmethylphosphane?
The InChIKey is HNYKNWYPPRGUTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21PS/c26-18-27-23-17-16-22(19-10-4-1-5-11-19)24(20-12-6-2-7-13-20)25(23)21-14-8-3-9-15-21/h1-17H,18,26H2.
What are the key properties of (2,3,4-triphenylphenyl)sulfanylmethylphosphane?
(2,3,4-triphenylphenyl)sulfanylmethylphosphane has a molecular weight of 384.48 g/mol, XLogP of 7.61, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,4-triphenylphenyl)sulfanylmethylphosphane is sourced from PubChem (CID 23186709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).