Home Other Building Blocks 5-Bromo-7-ethylindoline-2,3-dione

5-Bromo-7-ethylindoline-2,3-dione

CAS No.:
34921-60-3
Catalog Number:
AG01BHFQ
Molecular Formula:
C10H8BrNO2
Molecular Weight:
254.0800
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Product Description
Catalog Number:
AG01BHFQ
Chemical Name:
5-Bromo-7-ethylindoline-2,3-dione
CAS Number:
34921-60-3
Molecular Formula:
C10H8BrNO2
Molecular Weight:
254.0800
MDL Number:
MFCD08532137
IUPAC Name:
5-bromo-7-ethyl-1H-indole-2,3-dione
InChI:
InChI=1S/C10H8BrNO2/c1-2-5-3-6(11)4-7-8(5)12-10(14)9(7)13/h3-4H,2H2,1H3,(H,12,13,14)
InChI Key:
CTGQHGOEVARVKX-UHFFFAOYSA-N
SMILES:
CCc1cc(Br)cc2c1NC(=O)C2=O
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.974g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.083g/mol
Monoisotopic Mass:
252.974g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties