6-Cyanopyridine-2-sulfonyl chloride
Basic information
- CAS
1343041-93-9- Standard SMILES
N#Cc1cccc(S(=O)(=O)Cl)n1- InChIKey
MYMMVLIOCVILFV-UHFFFAOYSA-N- Molecular formula
- C6H3ClN2O2S
- Average molar mass
- 202.62 g/mol
- Monoisotopic mass
- 201.9603762
Names & identifiers
- Preferred name
- 6-Cyanopyridine-2-sulfonyl chloride
- IUPAC
- 6-cyanopyridine-2-sulfonyl chloride
- English name
- 6-Cyanopyridine-2-sulfonyl chloride
- Molecular formula
- C6H3ClN2O2S
- Molecular weight
- 202.62
Names & synonyms
6-cyanopyridine-2-sulfonyl chloride1343041-93-9RefChem:542017986-560-5MFCD20367377SCHEMBL18331403SCHEMBL302329476-Cyano-pyridine-2-sulfonyl chlorideAKOS0139149762-Pyridinesulfonyl chloride, 6-cyano-BS-53071E79850
Show more names
EN300-276914F781547
Database identifiers
- CAS
1343041-93-9- PubChem CID
- 64589409
- EC Number
- 986-560-5
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 79.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 299
Physicochemical properties
- Boiling point
- 368.2 · 368.2±27.0 °C(Predicted)
- Density
- 1.63 · 1.63±0.1 g/cm3(Predicted)
- pka
- -10.68 · -10.68±0.19(Predicted)
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, 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%)
Suppliers
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Related reactions
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Compound notes
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