Home Halogens 4-bromo-6-(chloromethyl)-2H-1,3-benzodioxole

4-bromo-6-(chloromethyl)-2H-1,3-benzodioxole

CAS No.:
65673-82-7
Catalog Number:
AG019X3R
Molecular Formula:
C8H6BrClO2
Molecular Weight:
249.4890
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Product Description
Catalog Number:
AG019X3R
Chemical Name:
4-bromo-6-(chloromethyl)-2H-1,3-benzodioxole
CAS Number:
65673-82-7
Molecular Formula:
C8H6BrClO2
Molecular Weight:
249.4890
MDL Number:
MFCD11182162
IUPAC Name:
4-bromo-6-(chloromethyl)-1,3-benzodioxole
InChI:
InChI=1S/C8H6BrClO2/c9-6-1-5(3-10)2-7-8(6)12-4-11-7/h1-2H,3-4H2
InChI Key:
SJBPZFVJNASLBI-UHFFFAOYSA-N
SMILES:
ClCc1cc(Br)c2c(c1)OCO2
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.924g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.488g/mol
Monoisotopic Mass:
247.924g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties