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2-[2-Fluoro-4-(methylsulfonyl)phenyl]-1,3-dioxolane

HCID 178590239
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
1346597-53-2
Standard SMILES
CS(=O)(=O)c1ccc(C2OCCO2)c(F)c1
InChIKey
PIOWQEXPUUWWKL-UHFFFAOYSA-N
Molecular formula
C10H11FO4S
Average molar mass
246.26 g/mol
Monoisotopic mass
246.03620816

Names & identifiers

Preferred name
2-[2-Fluoro-4-(methylsulfonyl)phenyl]-1,3-dioxolane
IUPAC
2-(2-fluoro-4-methylsulfonylphenyl)-1,3-dioxolane
English name
2-[2-Fluoro-4-(Methylsulfonyl)phenyl]-1,3-dioxolane
Molecular formula
C10H11FO4S
Molecular weight
246.26

Names & synonyms

1346597-53-22-[2-Fluoro-4-(methylsulfonyl)phenyl]-1,3-dioxolane2-(2-Fluoro-4-(methylsulfonyl)phenyl)-1,3-dioxolane2-(2-fluoro-4-methylsulfonylphenyl)-1,3-dioxolaneMFCD204914032-(2-FLUORO-4-METHANESULFONYLPHENYL)-1,3-DIOXOLANEAC3891AKOS022184101SY016709DB-019538CS-04449232-(2-fluoro-4-methylsulfonyl-phenyl)-1,3-dioxolane
Show more names
1,3-Dioxolane, 2-[2-fluoro-4-(methylsulfonyl)phenyl]-

Database identifiers

CAS
1346597-53-2
PubChem CID
71432794

Properties

Computed structural propertiesFilling in

XLogP
0.7
Topological polar surface area
61 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
331

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338
HS Code
2932990090 · 2932990090

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

hs_code
2932990090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Related reactions

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Compound notes

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