Home Halogens Methyl 4-bromoisoquinoline-1-carboxylate

Methyl 4-bromoisoquinoline-1-carboxylate

CAS No.:
1512077-05-2
Catalog Number:
AG00HXUQ
Molecular Formula:
C11H8BrNO2
Molecular Weight:
266.0907
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$263
- +
1g
97%
In Stock USA
United States
$638
- +
5g
97%
In Stock USA
United States
$1875
- +
Product Description
Catalog Number:
AG00HXUQ
Chemical Name:
Methyl 4-bromoisoquinoline-1-carboxylate
CAS Number:
1512077-05-2
Molecular Formula:
C11H8BrNO2
Molecular Weight:
266.0907
MDL Number:
MFCD22097871
IUPAC Name:
methyl 4-bromoisoquinoline-1-carboxylate
InChI:
InChI=1S/C11H8BrNO2/c1-15-11(14)10-8-5-3-2-4-7(8)9(12)6-13-10/h2-6H,1H3
InChI Key:
KNFXYFNXGJHAEI-UHFFFAOYSA-N
SMILES:
COC(=O)c1ncc(c2c1cccc2)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:
3  
Properties