Home Other Building Blocks 5-Bromo-3-methoxyisoquinoline

5-Bromo-3-methoxyisoquinoline

CAS No.:
1330750-62-3
Catalog Number:
AG009DEG
Molecular Formula:
C10H8BrNO
Molecular Weight:
238.0806
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$595
- +
Product Description
Catalog Number:
AG009DEG
Chemical Name:
5-Bromo-3-methoxyisoquinoline
CAS Number:
1330750-62-3
Molecular Formula:
C10H8BrNO
Molecular Weight:
238.0806
MDL Number:
MFCD19982316
IUPAC Name:
5-bromo-3-methoxyisoquinoline
InChI:
InChI=1S/C10H8BrNO/c1-13-10-5-8-7(6-12-10)3-2-4-9(8)11/h2-6H,1H3
InChI Key:
AQOJBAYGTPZJAY-UHFFFAOYSA-N
SMILES:
COc1ncc2c(c1)c(Br)ccc2
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.979g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.084g/mol
Monoisotopic Mass:
236.979g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties