Home Sulfos 5-bromo-1H-pyrrolo[2,3-b]pyridine-3-sulfonyl fluoride

5-bromo-1H-pyrrolo[2,3-b]pyridine-3-sulfonyl fluoride

CAS No.:
2138133-25-0
Catalog Number:
AG01EIY2
Molecular Formula:
C7H4BrFN2O2S
Molecular Weight:
279.0863
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Product Description
Catalog Number:
AG01EIY2
Chemical Name:
5-bromo-1H-pyrrolo[2,3-b]pyridine-3-sulfonyl fluoride
CAS Number:
2138133-25-0
Molecular Formula:
C7H4BrFN2O2S
Molecular Weight:
279.0863
MDL Number:
MFCD31446078
IUPAC Name:
5-bromo-1H-pyrrolo[2,3-b]pyridine-3-sulfonyl fluoride
InChI:
InChI=1S/C7H4BrFN2O2S/c8-4-1-5-6(14(9,12)13)3-11-7(5)10-2-4/h1-3H,(H,10,11)
InChI Key:
DVHXQAYBSISIGP-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1)c(c[nH]2)S(=O)(=O)F
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.916g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
279.083g/mol
Monoisotopic Mass:
277.916g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties