Home Halogens Methyl 5-bromoquinoline-8-carboxylate

Methyl 5-bromoquinoline-8-carboxylate

CAS No.:
1445781-45-2
Catalog Number:
AG001JRT
Molecular Formula:
C11H8BrNO2
Molecular Weight:
266.0907
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Product Description
Catalog Number:
AG001JRT
Chemical Name:
Methyl 5-bromoquinoline-8-carboxylate
CAS Number:
1445781-45-2
Molecular Formula:
C11H8BrNO2
Molecular Weight:
266.0907
MDL Number:
MFCD19703294
IUPAC Name:
methyl 5-bromoquinoline-8-carboxylate
InChI:
InChI=1S/C11H8BrNO2/c1-15-11(14)8-4-5-9(12)7-3-2-6-13-10(7)8/h2-6H,1H3
InChI Key:
IHRLTIQTMTVDGZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c2c1nccc2)Br
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.974g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.094g/mol
Monoisotopic Mass:
264.974g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties