Home Bromides 1015060-31-7
1015060-31-7,MFCD18254357
Catalog No.:AA0004KO
1015060-31-7 | 5-Bromo-2-(chloromethyl)-3-methylpyridine
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Technical Information
Catalog Number:
AA0004KO
Chemical Name:
5-Bromo-2-(chloromethyl)-3-methylpyridine
CAS Number:
1015060-31-7
Molecular Formula:
C7H7BrClN
Molecular Weight:
220.4942
MDL Number:
MFCD18254357
IUPAC Name:
5-bromo-2-(chloromethyl)-3-methylpyridine
InChI:
InChI=1S/C7H7BrClN/c1-5-2-6(8)4-10-7(5)3-9/h2,4H,3H2,1H3
InChI Key:
BOZSCICYPVCIGV-UHFFFAOYSA-N
SMILES:
ClCc1ncc(cc1C)Br
Properties
Computed Properties
 
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.945g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.494g/mol
Monoisotopic Mass:
218.945g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Synonyms
 
5-BROMO-2-(CHLOROMETHYL)-3-METHYLPYRIDINE 
1015060-31-7 
FT-0735908 
Pyridine,5-bromo-2-(chloromethyl)-3-methyl- 
Pyridine, 5-bromo-2-(chloromethyl)-3-methyl- 
SCHEMBL2112705 
CTK3J9849 
DTXSID40699492 
ZINC90500506 
FCH1365004 
5-Bromo-2-chloromethyl-3-methylpyridine 
AX8300016 
DB-058607 
Literature
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