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318276-72-1 | 6-Bromocinnoline
CAS No: 318276-72-1 Catalog No: AG0038TJ MDL No:MFCD09834644
Product Description
Catalog Number:
AG0038TJ
Chemical Name:
6-Bromocinnoline
CAS Number:
318276-72-1
Molecular Formula:
C8H5BrN2
Molecular Weight:
209.0427
MDL Number:
MFCD09834644
IUPAC Name:
6-bromocinnoline
InChI:
InChI=1S/C8H5BrN2/c9-7-1-2-8-6(5-7)3-4-10-11-8/h1-5H
InChI Key:
NUILLMMTUCMJNA-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)ccnn2
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.964g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.046g/mol
Monoisotopic Mass:
207.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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