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Home > Bromides > 1190310-00-9
1190310-00-9 | 1H-Pyrrolo[2,3-b]pyridine, 4-bromo-6-methoxy-
CAS No: 1190310-00-9 Catalog No: AG000P3Y MDL No:MFCD12962672
Product Description
Catalog Number:
AG000P3Y
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 4-bromo-6-methoxy-
CAS Number:
1190310-00-9
Molecular Formula:
C8H7BrN2O
Molecular Weight:
227.0580
MDL Number:
MFCD12962672
IUPAC Name:
4-bromo-6-methoxy-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C8H7BrN2O/c1-12-7-4-6(9)5-2-3-10-8(5)11-7/h2-4H,1H3,(H,10,11)
InChI Key:
UOCZORJPSDNBFT-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c2c(n1)[nH]cc2
Properties
Complexity:
167
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:
1
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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