sales@angenesci.com
Login | Register
logo
Structures Search
Home Halogens 1H-Indole-2,3-dione, 4,5-dichloro-

1H-Indole-2,3-dione, 4,5-dichloro-

CAS No.:
1677-47-0
Catalog Number:
AG001XJN
Molecular Formula:
C8H3Cl2NO2
Molecular Weight:
216.0209
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG001XJN
Chemical Name:
1H-Indole-2,3-dione, 4,5-dichloro-
CAS Number:
1677-47-0
Molecular Formula:
C8H3Cl2NO2
Molecular Weight:
216.0209
MDL Number:
MFCD00185014
IUPAC Name:
4,5-dichloro-1H-indole-2,3-dione
InChI:
InChI=1S/C8H3Cl2NO2/c9-3-1-2-4-5(6(3)10)7(12)8(13)11-4/h1-2H,(H,11,12,13)
InChI Key:
WWSWHYAXEFLETD-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1=O)c(Cl)c(cc2)Cl
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.954g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.017g/mol
Monoisotopic Mass:
214.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Selective inhibition of carboxylesterases by isatins, indole-2,3-diones. Journal of medicinal chemistry 20070419
Properties