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175424-32-5 | 2H-Pyrrolo[2,3-b]pyridin-2-one, 5-bromo-1,3-dihydro-1,3,3-trimethyl-
CAS No: 175424-32-5 Catalog No: AG0020Z0 MDL No:
Product Description
Catalog Number:
AG0020Z0
Chemical Name:
2H-Pyrrolo[2,3-b]pyridin-2-one, 5-bromo-1,3-dihydro-1,3,3-trimethyl-
CAS Number:
175424-32-5
Molecular Formula:
C10H11BrN2O
Molecular Weight:
255.1111
IUPAC Name:
5-bromo-1,3,3-trimethylpyrrolo[2,3-b]pyridin-2-one
InChI:
InChI=1S/C10H11BrN2O/c1-10(2)7-4-6(11)5-12-8(7)13(3)9(10)14/h4-5H,1-3H3
InChI Key:
YCNHZJHSIZHUIA-UHFFFAOYSA-N
SMILES:
CN1C(=O)C(c2c1ncc(c2)Br)(C)C
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.005g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.115g/mol
Monoisotopic Mass:
254.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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