Home Other Building Blocks AKOS BBS-00005529

AKOS BBS-00005529

CAS No.:
39033-45-9
Catalog Number:
AG00BZ7V
Molecular Formula:
C8H5Cl2NO
Molecular Weight:
202.0374
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Product Description
Catalog Number:
AG00BZ7V
Chemical Name:
AKOS BBS-00005529
CAS Number:
39033-45-9
Molecular Formula:
C8H5Cl2NO
Molecular Weight:
202.0374
MDL Number:
MFCD00460619
IUPAC Name:
3,3-dichloro-1H-indol-2-one
InChI:
InChI=1S/C8H5Cl2NO/c9-8(10)5-3-1-2-4-6(5)11-7(8)12/h1-4H,(H,11,12)
InChI Key:
WGGLCBPNOIWKDL-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1(Cl)Cl)cccc2
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.975g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.034g/mol
Monoisotopic Mass:
200.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties