Home Halogens 1,3-Benzodioxole, 5-(bromomethyl)-6-iodo-

1,3-Benzodioxole, 5-(bromomethyl)-6-iodo-

CAS No.:
153254-99-0
Catalog Number:
AG00HY4A
Molecular Formula:
C8H6BrIO2
Molecular Weight:
340.9405
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Product Description
Catalog Number:
AG00HY4A
Chemical Name:
1,3-Benzodioxole, 5-(bromomethyl)-6-iodo-
CAS Number:
153254-99-0
Molecular Formula:
C8H6BrIO2
Molecular Weight:
340.9405
MDL Number:
MFCD30067160
IUPAC Name:
5-(bromomethyl)-6-iodo-1,3-benzodioxole
InChI:
InChI=1S/C8H6BrIO2/c9-3-5-1-7-8(2-6(5)10)12-4-11-7/h1-2H,3-4H2
InChI Key:
VRDLFDFGPIQUDK-UHFFFAOYSA-N
SMILES:
BrCc1cc2OCOc2cc1I
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.86g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.942g/mol
Monoisotopic Mass:
339.86g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties