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2-[(2,6-Dichlorophenyl)sulfinyl]-1,1-diphenyl-1-ethanol

HCID 178653370
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Basic information

CAS
252026-44-1
Standard SMILES
O=S(CC(O)(c1ccccc1)c1ccccc1)c1c(Cl)cccc1Cl
InChIKey
JUQNPUVUGMRWSE-UHFFFAOYSA-N
Molecular formula
C20H16Cl2O2S
Average molar mass
391.3 g/mol
Monoisotopic mass
390.0248063

Names & identifiers

Preferred name
2-[(2,6-Dichlorophenyl)sulfinyl]-1,1-diphenyl-1-ethanol
IUPAC
2-(2,6-dichlorophenyl)sulfinyl-1,1-diphenylethanol
English name
2-[(2,6-DICHLOROPHENYL)SULFINYL]-1,1-DIPHENYL-1-ETHANOL
Molecular formula
C20H16Cl2O2S
Molecular weight
391.31

Names & synonyms

252026-44-12-[(2,6-dichlorophenyl)sulfinyl]-1,1-diphenyl-1-ethanol2-(2,6-dichlorobenzenesulfinyl)-1,1-diphenylethan-1-ol2-(2,6-dichlorophenyl)sulfinyl-1,1-diphenylethanolBionet1_001211Oprea1_181354HMS571I13MFCD00214939AKOS00507472310H-348S2-(2,6-dichlorophenyl)sulfinyl-1,1-diphenyl-ethanolBenzenemethanol, α-[[(2,6-dichlorophenyl)sulfinyl]methyl]-α-phenyl-

Database identifiers

CAS
252026-44-1
PubChem CID
2765167

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
56.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
25
Formal charge
0
Complexity
419

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

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Compound notes

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