Home Halogens 3-bromoisoquinolin-1-amine

3-bromoisoquinolin-1-amine

CAS No.:
40073-36-7
Catalog Number:
AG01C5BT
Molecular Formula:
C9H7BrN2
Molecular Weight:
223.0693
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Product Description
Catalog Number:
AG01C5BT
Chemical Name:
3-bromoisoquinolin-1-amine
CAS Number:
40073-36-7
Molecular Formula:
C9H7BrN2
Molecular Weight:
223.0693
MDL Number:
MFCD03695826
IUPAC Name:
3-bromoisoquinolin-1-amine
InChI:
InChI=1S/C9H7BrN2/c10-8-5-6-3-1-2-4-7(6)9(11)12-8/h1-5H,(H2,11,12)
InChI Key:
JFGHICQGSSFEHW-UHFFFAOYSA-N
SMILES:
Brc1cc2ccccc2c(n1)N
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.979g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.073g/mol
Monoisotopic Mass:
221.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties