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Phosphine, tris(p-methylthiophenyl)-

HCID 207408
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Basic information

CAS
29949-80-2
Standard SMILES
CSc1ccc(P(c2ccc(SC)cc2)c2ccc(SC)cc2)cc1
InChIKey
SYRCIUTYFPQGNK-UHFFFAOYSA-N
Molecular formula
C21H21PS3
Average molar mass
400.6 g/mol
Monoisotopic mass
400.05430119

Names & identifiers

Preferred name
Phosphine, tris(p-methylthiophenyl)-
IUPAC
tris(4-methylsulfanylphenyl)phosphane
English name
Tris[4-(methylthio)phenyl]phosphine
Molecular weight
0

Names & synonyms

Phosphine, tris(p-methylthiophenyl)-Tris(p-methylthiophenyl)phosphineBRN 287649229949-80-2DTXSID60184052RefChem:370159DTXCID70106543tris(4-methylsulfanylphenyl)phosphanetris[4-(methylsulfanyl)phenyl]phosphaneSCHEMBL4622420Tris[4-(methylthio)phenyl]phosphine

Database identifiers

CAS
29949-80-2
PubChem CID
207408
DTXSID
DTXSID60184052
Nikkaji
J50.235I

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
75.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
25
Formal charge
0
Complexity
310

Related reactions

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Compound notes

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