1-(4-Iodobenzenesulfonyl)piperidin-4-amine
Basic information
- CAS
1154258-05-5- Standard SMILES
NC1CCN(S(=O)(=O)c2ccc(I)cc2)CC1- InChIKey
SPFBIKWAGVBODP-UHFFFAOYSA-N- Molecular formula
- C11H15IN2O2S
- Average molar mass
- 366.22 g/mol
- Monoisotopic mass
- 365.9899
Names & identifiers
- Preferred name
- 1-(4-Iodobenzenesulfonyl)piperidin-4-amine
- IUPAC
- 1-(4-iodophenyl)sulfonylpiperidin-4-amine
- English name
- 1-(4-Iodobenzenesulfonyl)piperidin-4-amine
- Molecular formula
- C11H15IN2O2S
- Molecular weight
- 366.22
Names & synonyms
1-(4-iodobenzenesulfonyl)piperidin-4-amine1154258-05-51-(4-iodophenyl)sulfonylpiperidin-4-amine1-[(4-iodobenzene)sulfonyl]piperidin-4-amineEWB25805AKOS005850935CS-0253193EN300-62716G43747Z2348963634-Piperidinamine, 1-[(4-iodophenyl)sulfonyl]-
Database identifiers
- CAS
1154258-05-5- PubChem CID
- 43556367
- EC Number
- 113-087-6
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 339
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, 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
0 records
No reaction records under the current filter.
Compound notes
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