Home Other Building Blocks 1-BROMO-6,7-DIMETHOXYISOQUINOLINE

1-BROMO-6,7-DIMETHOXYISOQUINOLINE

CAS No.:
949139-74-6
Catalog Number:
AG01E3MT
Molecular Formula:
C11H10BrNO2
Molecular Weight:
268.1066
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Product Description
Catalog Number:
AG01E3MT
Chemical Name:
1-BROMO-6,7-DIMETHOXYISOQUINOLINE
CAS Number:
949139-74-6
Molecular Formula:
C11H10BrNO2
Molecular Weight:
268.1066
IUPAC Name:
1-bromo-6,7-dimethoxyisoquinoline
InChI:
InChI=1S/C11H10BrNO2/c1-14-9-5-7-3-4-13-11(12)8(7)6-10(9)15-2/h3-6H,1-2H3
InChI Key:
XJERWSWRQPHTIK-UHFFFAOYSA-N
SMILES:
COc1cc2c(Br)nccc2cc1OC
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.989g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.11g/mol
Monoisotopic Mass:
266.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties