Home Halogens 5-chloro-3-(methylamino)-2,3-dihydro-1lambda6-benzothiophene-1,1-dione hydrochloride

5-chloro-3-(methylamino)-2,3-dihydro-1lambda6-benzothiophene-1,1-dione hydrochloride

CAS No.:
1423034-47-2
Catalog Number:
AG01A1WC
Molecular Formula:
C9H11Cl2NO2S
Molecular Weight:
268.1601
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Product Description
Catalog Number:
AG01A1WC
Chemical Name:
5-chloro-3-(methylamino)-2,3-dihydro-1lambda6-benzothiophene-1,1-dione hydrochloride
CAS Number:
1423034-47-2
Molecular Formula:
C9H11Cl2NO2S
Molecular Weight:
268.1601
MDL Number:
MFCD22565972
IUPAC Name:
5-chloro-N-methyl-1,1-dioxo-2,3-dihydro-1-benzothiophen-3-amine;hydrochloride
InChI:
InChI=1S/C9H10ClNO2S.ClH/c1-11-8-5-14(12,13)9-3-2-6(10)4-7(8)9;/h2-4,8,11H,5H2,1H3;1H
InChI Key:
SBVVTCOCNYLBAE-UHFFFAOYSA-N
SMILES:
CNC1CS(=O)(=O)c2c1cc(Cl)cc2.Cl
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.989g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
268.152g/mol
Monoisotopic Mass:
266.989g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties