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Home > Bromides > 1190310-25-8
1190310-25-8 | 2H-Pyrrolo[2,3-b]pyridin-2-one, 4-bromo-1,3-dihydro-6-methoxy-
CAS No: 1190310-25-8 Catalog No: AG000HGD MDL No:
Product Description
Catalog Number:
AG000HGD
Chemical Name:
2H-Pyrrolo[2,3-b]pyridin-2-one, 4-bromo-1,3-dihydro-6-methoxy-
CAS Number:
1190310-25-8
Molecular Formula:
C8H7BrN2O2
Molecular Weight:
243.0574
IUPAC Name:
4-bromo-6-methoxy-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
InChI:
InChI=1S/C8H7BrN2O2/c1-13-7-3-5(9)4-2-6(12)10-8(4)11-7/h3H,2H2,1H3,(H,10,11,12)
InChI Key:
IEYUIEZLIRKBGH-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c2c(n1)NC(=O)C2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.969g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.06g/mol
Monoisotopic Mass:
241.969g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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