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N-(pyridin-2-ylmethyl)sulfamide

HCID 21041237
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
924307-96-0
Standard SMILES
NS(=O)(=O)NCc1ccccn1
InChIKey
QCNARIWDSHXOBP-UHFFFAOYSA-N
Molecular formula
C6H9N3O2S
Average molar mass
187.22 g/mol
Monoisotopic mass
187.04154771

Names & identifiers

Preferred name
N-(pyridin-2-ylmethyl)sulfamide
IUPAC
2-[(sulfamoylamino)methyl]pyridine

Names & synonyms

N-(pyridin-2-ylmethyl)sulfamide924307-96-0N-(pyridin-2-ylmethyl)aminosulfonamideN-(2-Pyridinylmethyl)sulfamideN-[(pyridin-2-yl)methyl]aminosulfonamide2-[(sulfamoylamino)methyl]pyridineSCHEMBL13066644AKOS026727786EN300-30863Z300109946

Database identifiers

CAS
924307-96-0
PubChem CID
21041237
EC Number
129-975-1

Properties

Computed structural properties

XLogP
-0.9
Topological polar surface area
93.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
221

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

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, 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

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Compound notes

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