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4964-71-0 | 5-Bromoquinoline
CAS No: 4964-71-0 Catalog No: AG003MKZ MDL No:MFCD00234481
Product Description
Catalog Number:
AG003MKZ
Chemical Name:
5-Bromoquinoline
CAS Number:
4964-71-0
Molecular Formula:
C9H6BrN
Molecular Weight:
208.0546
MDL Number:
MFCD00234481
IUPAC Name:
5-bromoquinoline
InChI:
InChI=1S/C9H6BrN/c10-8-4-1-5-9-7(8)3-2-6-11-9/h1-6H
InChI Key:
CHODTZCXWXCALP-UHFFFAOYSA-N
SMILES:
Brc1cccc2c1cccn2
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.968g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.058g/mol
Monoisotopic Mass:
206.968g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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