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4-Chloro-n-propylbenzenesulfonamide

HCID 101302
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Basic information

CAS
28860-18-6
Standard SMILES
CCCNS(=O)(=O)c1ccc(Cl)cc1
InChIKey
IQAWZHMVSPVZCM-UHFFFAOYSA-N
Molecular formula
C9H12ClNO2S
Average molar mass
233.72 g/mol
Monoisotopic mass
233.0277275

Names & identifiers

Preferred name
4-Chloro-n-propylbenzenesulfonamide
IUPAC
4-chloro-N-propylbenzenesulfonamide
English name
4-Chloro-N-propylbenzenesulfonamide
Molecular weight
0

Names & synonyms

4-chloro-n-propylbenzenesulfonamideBenzenesulfonamide, p-chloro-N-propyl-N-Propyl-p-chlorobenzenesulfonamideBenzenesulfonamide, 4-chloro-N-propyl-p-Chloro-N-propylbenzenesulfonamideNSC 406135BRN 2728849Q8NN10N5Z0AI3-01435NSC-406135UNII-Q8NN10N5Z0DTXSID90183058
Show more names
RefChem:198643DTXCID00105549Benzenesulfonamide, 4-chloro-N-propyl-(9CI)4-chloro-N-propylbenzene-1-sulfonamide28860-18-6NSC406135Oprea1_309109SCHEMBL11883523

Database identifiers

CAS
28860-18-6
PubChem CID
101302
DTXSID
DTXSID90183058
UNII
Q8NN10N5Z0
Nikkaji
J41.393C

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
54.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
14
Formal charge
0
Complexity
252

Physicochemical properties

FDA UNII
8 NN10N5Z0 · Q8NN10N5Z0
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P301+P312-P302+P352-P304+P340-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
H302-H315-H319-H335
Precautionary statements
P261-P301+P312-P302+P352-P304+P340-P305+P351+P338

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Compound notes

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