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Home > Bromides > 1799612-41-1
1799612-41-1 | 1-Bromo-3-chloro-4-iodo-2-methylbenzene
CAS No: 1799612-41-1 Catalog No: AG01EUEY MDL No:
Product Description
Catalog Number:
AG01EUEY
Chemical Name:
1-Bromo-3-chloro-4-iodo-2-methylbenzene
CAS Number:
1799612-41-1
Molecular Formula:
C7H5BrClI
Molecular Weight:
331.3761
IUPAC Name:
1-bromo-3-chloro-4-iodo-2-methylbenzene
InChI:
InChI=1S/C7H5BrClI/c1-4-5(8)2-3-6(10)7(4)9/h2-3H,1H3
InChI Key:
ONVJQGQREQCKKJ-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1C)Cl)I
Properties
Complexity:
120
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:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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