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1000340-17-9 | 1H-Pyrrolo[2,3-b]pyridine, 3-bromo-5-chloro-6-methyl-
CAS No: 1000340-17-9 Catalog No: AG0000D3 MDL No:MFCD09880106
Product Description
Catalog Number:
AG0000D3
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 3-bromo-5-chloro-6-methyl-
CAS Number:
1000340-17-9
Molecular Formula:
C8H6BrClN2
Molecular Weight:
245.5036
MDL Number:
MFCD09880106
IUPAC Name:
3-bromo-5-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C8H6BrClN2/c1-4-7(10)2-5-6(9)3-11-8(5)12-4/h2-3H,1H3,(H,11,12)
InChI Key:
OGNATGJYATUIKC-UHFFFAOYSA-N
SMILES:
Cc1nc2[nH]cc(c2cc1Cl)Br
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.94g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.504g/mol
Monoisotopic Mass:
243.94g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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