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1000341-51-4 | 1H-Pyrrolo[3,2-b]pyridine, 5-bromo-
CAS No: 1000341-51-4 Catalog No: AG0000HQ MDL No:MFCD09263244
Product Description
Catalog Number:
AG0000HQ
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine, 5-bromo-
CAS Number:
1000341-51-4
Molecular Formula:
C7H5BrN2
Molecular Weight:
197.0320
MDL Number:
MFCD09263244
IUPAC Name:
5-bromo-1H-pyrrolo[3,2-b]pyridine
InChI:
InChI=1S/C7H5BrN2/c8-7-2-1-5-6(10-7)3-4-9-5/h1-4,9H
InChI Key:
KJTANNMEOBCHKP-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(n1)cc[nH]2
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.964g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.035g/mol
Monoisotopic Mass:
195.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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