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31928-47-9 | 4-Bromo-2-chloro-1-iodobenzene
CAS No: 31928-47-9 Catalog No: AG003KW5 MDL No:MFCD00079709
Product Description
Catalog Number:
AG003KW5
Chemical Name:
4-Bromo-2-chloro-1-iodobenzene
CAS Number:
31928-47-9
Molecular Formula:
C6H3BrClI
Molecular Weight:
317.3495
MDL Number:
MFCD00079709
IUPAC Name:
4-bromo-2-chloro-1-iodobenzene
InChI:
InChI=1S/C6H3BrClI/c7-4-1-2-6(9)5(8)3-4/h1-3H
InChI Key:
OHHKQBZOURGNLR-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)Cl)I
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.815g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.348g/mol
Monoisotopic Mass:
315.815g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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