Home Halogens 1-(1-bromoethyl)-2-chlorobenzene

1-(1-bromoethyl)-2-chlorobenzene

CAS No.:
66481-74-1
Catalog Number:
AG019WIH
Molecular Formula:
C8H8BrCl
Molecular Weight:
219.5061
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Product Description
Catalog Number:
AG019WIH
Chemical Name:
1-(1-bromoethyl)-2-chlorobenzene
CAS Number:
66481-74-1
Molecular Formula:
C8H8BrCl
Molecular Weight:
219.5061
MDL Number:
MFCD11180305
IUPAC Name:
1-(1-bromoethyl)-2-chlorobenzene
InChI:
InChI=1S/C8H8BrCl/c1-6(9)7-4-2-3-5-8(7)10/h2-6H,1H3
InChI Key:
QYKKDCRHMDKWFK-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1Cl)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:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Literature
Title Journal
rac-(E)-3-[1-(2-Chloro-phen-yl)eth-yl]-5-methyl-N-nitro-1,3,5-oxadiazinan-4-imine. Acta crystallographica. Section E, Structure reports online 20100901
Properties