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Home > Bromides > 1190316-79-0
1190316-79-0 | 2H-Pyrrolo[2,3-b]pyridin-2-one, 5-bromo-1,3-dihydro-4-methyl-
CAS No: 1190316-79-0 Catalog No: AG000HPS MDL No:MFCD12962761
Product Description
Catalog Number:
AG000HPS
Chemical Name:
2H-Pyrrolo[2,3-b]pyridin-2-one, 5-bromo-1,3-dihydro-4-methyl-
CAS Number:
1190316-79-0
Molecular Formula:
C8H7BrN2O
Molecular Weight:
227.0580
MDL Number:
MFCD12962761
IUPAC Name:
5-bromo-4-methyl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
InChI:
InChI=1S/C8H7BrN2O/c1-4-5-2-7(12)11-8(5)10-3-6(4)9/h3H,2H2,1H3,(H,10,11,12)
InChI Key:
DEJPIJKTSUOZTK-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)c(C)c(cn2)Br
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.974g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.061g/mol
Monoisotopic Mass:
225.974g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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