Home Halogens 8-bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline

8-bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline

CAS No.:
1341214-45-6
Catalog Number:
AG01A1BW
Molecular Formula:
C9H9BrFN
Molecular Weight:
230.0769
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Product Description
Catalog Number:
AG01A1BW
Chemical Name:
8-bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline
CAS Number:
1341214-45-6
Molecular Formula:
C9H9BrFN
Molecular Weight:
230.0769
MDL Number:
MFCD18306474
IUPAC Name:
8-bromo-5-fluoro-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C9H9BrFN/c10-8-1-2-9(11)6-3-4-12-5-7(6)8/h1-2,12H,3-5H2
InChI Key:
VVZOZQVEJFKOPE-UHFFFAOYSA-N
SMILES:
Fc1ccc(c2c1CCNC2)Br
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.99g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.08g/mol
Monoisotopic Mass:
228.99g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties