Home Halogens 5-bromo-1-methyl-1,2,3,4-tetrahydroisoquinoline

5-bromo-1-methyl-1,2,3,4-tetrahydroisoquinoline

CAS No.:
1176414-91-7
Catalog Number:
AG01A40W
Molecular Formula:
C10H12BrN
Molecular Weight:
226.1130
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Product Description
Catalog Number:
AG01A40W
Chemical Name:
5-bromo-1-methyl-1,2,3,4-tetrahydroisoquinoline
CAS Number:
1176414-91-7
Molecular Formula:
C10H12BrN
Molecular Weight:
226.1130
MDL Number:
MFCD18306483
IUPAC Name:
5-bromo-1-methyl-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C10H12BrN/c1-7-8-3-2-4-10(11)9(8)5-6-12-7/h2-4,7,12H,5-6H2,1H3
InChI Key:
VPKHWEFDYAMWOS-UHFFFAOYSA-N
SMILES:
CC1NCCc2c1cccc2Br
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.015g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.117g/mol
Monoisotopic Mass:
225.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties