Home Other Building Blocks 5-Bromo-2-methylisoquinolin-1(2h)-one

5-Bromo-2-methylisoquinolin-1(2h)-one

CAS No.:
1367905-79-0
Catalog Number:
AG00A04J
Molecular Formula:
C10H8BrNO
Molecular Weight:
238.0806
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$649
- +
1g
95%
1 week
United States
$1262
- +
Product Description
Catalog Number:
AG00A04J
Chemical Name:
5-Bromo-2-methylisoquinolin-1(2h)-one
CAS Number:
1367905-79-0
Molecular Formula:
C10H8BrNO
Molecular Weight:
238.0806
MDL Number:
MFCD22034847
IUPAC Name:
5-bromo-2-methylisoquinolin-1-one
InChI:
InChI=1S/C10H8BrNO/c1-12-6-5-7-8(10(12)13)3-2-4-9(7)11/h2-6H,1H3
InChI Key:
ATCBXWHELADABE-UHFFFAOYSA-N
SMILES:
Cn1ccc2c(c1=O)cccc2Br
Properties
Complexity:
251  
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:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.084g/mol
Monoisotopic Mass:
236.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties