Home Halogens 4-bromo-7-chloroisoquinoline

4-bromo-7-chloroisoquinoline

CAS No.:
953421-72-2
Catalog Number:
AG00IIZX
Molecular Formula:
C9H5BrClN
Molecular Weight:
242.4997
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Product Description
Catalog Number:
AG00IIZX
Chemical Name:
4-bromo-7-chloroisoquinoline
CAS Number:
953421-72-2
Molecular Formula:
C9H5BrClN
Molecular Weight:
242.4997
IUPAC Name:
4-bromo-7-chloroisoquinoline
InChI:
InChI=1S/C9H5BrClN/c10-9-5-12-4-6-3-7(11)1-2-8(6)9/h1-5H
InChI Key:
ZQABKYUYLHWNCU-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)cncc2Br
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.929g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.5g/mol
Monoisotopic Mass:
240.929g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties