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115170-40-6 | 1H-Pyrrolo[2,3-b]pyridine, 5-bromo-2,3-dihydro-
CAS No: 115170-40-6 Catalog No: AG000GDP MDL No:MFCD06659750
Product Description
Catalog Number:
AG000GDP
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 5-bromo-2,3-dihydro-
CAS Number:
115170-40-6
Molecular Formula:
C7H7BrN2
Molecular Weight:
199.0479
MDL Number:
MFCD06659750
IUPAC Name:
5-bromo-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C7H7BrN2/c8-6-3-5-1-2-9-7(5)10-4-6/h3-4H,1-2H2,(H,9,10)
InChI Key:
UZGNFPCHQUHZAI-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1)CCN2
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.979g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.051g/mol
Monoisotopic Mass:
197.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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