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1261817-10-0 | Benzene, 4-bromo-2-(chloromethyl)-1-iodo-
CAS No: 1261817-10-0 Catalog No: AG000S0Z MDL No:MFCD18391683
Product Description
Catalog Number:
AG000S0Z
Chemical Name:
Benzene, 4-bromo-2-(chloromethyl)-1-iodo-
CAS Number:
1261817-10-0
Molecular Formula:
C7H5BrClI
Molecular Weight:
331.3761
MDL Number:
MFCD18391683
IUPAC Name:
4-bromo-2-(chloromethyl)-1-iodobenzene
InChI:
InChI=1S/C7H5BrClI/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,4H2
InChI Key:
OVMPAVCSOVHNOB-UHFFFAOYSA-N
SMILES:
ClCc1cc(Br)ccc1I
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.831g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.375g/mol
Monoisotopic Mass:
329.831g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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