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2-Amino-N-isopropylbenzenesulfonamide

HCID 16783465
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
761435-31-8
Standard SMILES
CC(C)NS(=O)(=O)c1ccccc1N
InChIKey
PFMDLZQSUMZMHZ-UHFFFAOYSA-N
Molecular formula
C9H14N2O2S
Average molar mass
214.29 g/mol
Monoisotopic mass
214.07759869

Names & identifiers

Preferred name
2-Amino-N-isopropylbenzenesulfonamide
IUPAC
2-amino-N-propan-2-ylbenzenesulfonamide
English name
2-amino-N-isopropylbenzenesulfonamide
Molecular formula
C9H14N2O2S
Molecular weight
214.28

Names & synonyms

2-AMINO-N-ISOPROPYLBENZENESULFONAMIDE761435-31-8N-isopropyl 2-aminobenzenesulfonamideMFCD097301752-amino-N-propan-2-ylbenzenesulfonamide2-amino-N-(propan-2-yl)benzene-1-sulfonamideSCHEMBL375390DTXSID105884252-amino-N-isopropyl-benzenesulfonamideAMY4692SCHEMBL31732804AKOS000138870
Show more names
UKRORGSYN-BB BBV-022239Benzenesulfonamide, 2-amino-N-(1-methylethyl)-
DS-0335SB78710SY066489CS-0078842F076132

Database identifiers

CAS
761435-31-8
PubChem CID
16783465
DTXSID
DTXSID10588425

Properties

Computed structural propertiesFilling in

XLogP
1.4
Topological polar surface area
80.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
Formal charge
0
Complexity
269

Physicochemical properties

storage temp.
Keep in dark place,Inert atmosphere,Room temperature
Appearance
White to off-white Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-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.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Related reactions

6 records
New reaction record
HRID 202651 reaction equation
HRID 202651As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1366274 reaction equation
HRID 1366274As reactantuspto-grants-2011_02
HRID 1565569 reaction equation
HRID 1565569As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1887710 reaction equation
HRID 1887710As productuspto-grants-2013_08
HRID 2382643 reaction equation
HRID 2382643As reactantuspto-grants-2012_09
HRID 2424378 reaction equation
HRID 2424378As reactantuspto-grants-2011_06

Compound notes

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