Home Halogens 1-bromo-3-(chloromethyl)-2-methylbenzene

1-bromo-3-(chloromethyl)-2-methylbenzene

CAS No.:
1261449-18-6
Catalog Number:
AG01A3AX
Molecular Formula:
C8H8BrCl
Molecular Weight:
219.5061
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Product Description
Catalog Number:
AG01A3AX
Chemical Name:
1-bromo-3-(chloromethyl)-2-methylbenzene
CAS Number:
1261449-18-6
Molecular Formula:
C8H8BrCl
Molecular Weight:
219.5061
MDL Number:
MFCD18392018
IUPAC Name:
1-bromo-3-(chloromethyl)-2-methylbenzene
InChI:
InChI=1S/C8H8BrCl/c1-6-7(5-10)3-2-4-8(6)9/h2-4H,5H2,1H3
InChI Key:
RBLQMXTZTSXCJV-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1C)Br
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.95g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.506g/mol
Monoisotopic Mass:
217.95g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties