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Oxane-4-sulfonyl fluoride

HCID 54594802
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Basic information

CAS
1334148-27-4
Standard SMILES
O=S(=O)(F)C1CCOCC1
InChIKey
NOECGOQFZUPHLI-UHFFFAOYSA-N
Molecular formula
C5H9FO3S
Average molar mass
168.19 g/mol
Monoisotopic mass
168.02564348

Names & identifiers

Preferred name
Oxane-4-sulfonyl fluoride
IUPAC
oxane-4-sulfonyl fluoride

Names & synonyms

oxane-4-sulfonyl fluoride1334148-27-4RefChem:857071872-060-3TETRAHYDRO-2H-PYRAN-4-SULFONYL FLUORIDEMFCD19982472oxane-4-sulfonylfluorideC5H9FO3Stetrahydropyran-4-sulfonyl fluorideJDC14827AKOS026727098AT20716
Show more names
EN300-83027F840136Z1238548165

Database identifiers

CAS
1334148-27-4
PubChem CID
54594802
EC Number
872-060-3

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
51.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
187

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Related reactions

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Compound notes

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