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5-Bromo-4-methylthiophene-2-sulfonamide

HCID 22019533
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Basic information

CAS
519055-69-7
Standard SMILES
Cc1cc(S(N)(=O)=O)sc1Br
InChIKey
DHBGCIHMCCBTPL-UHFFFAOYSA-N
Molecular formula
C5H6BrNO2S2
Average molar mass
256.1 g/mol

Names & identifiers

Preferred name
5-Bromo-4-methylthiophene-2-sulfonamide
IUPAC
5-bromo-4-methylthiophene-2-sulfonamide
English name
5-bromo-4-methylthiophene-2-sulfonamide
Molecular formula
C5H6BrNO2S2
Molecular weight
256.14064

Names & synonyms

5-bromo-4-methylthiophene-2-sulfonamide519055-69-7SCHEMBL5512490DHBGCIHMCCBTPL-UHFFFAOYSA-NUVA05569AKOS0184486205-Bromo-4-methyl-2-thiophenesulfonamide5-bromo-4-methyl-thiophene-2-sulfonamideDB-206939CS-0230189EN300-102665G49573
Show more names
Z1357801287

Database identifiers

CAS
519055-69-7
PubChem CID
22019533
EC Number
174-174-2

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
96.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
235

Physicochemical properties

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

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%)

Safety data

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

Chemistry & industry

Upstream & downstream products

Downstream products

2-Thiophenesulfonamide,4-methyl-(9CI)

Suppliers

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Related reactions

3 records
New reaction record
HRID 6960 reaction equation
HRID 6960As reactantuspto-grants-2006_08
HRID 1297165 reaction equation
HRID 1297165As reactantuspto-grants-2007_07
HRID 2127327 reaction equation
HRID 2127327As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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