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1609264-62-1 | Benzenamine, 4-bromo-2-iodo-5-methyl-
CAS No: 1609264-62-1 Catalog No: AG001VHE MDL No:MFCD27995559
Product Description
Catalog Number:
AG001VHE
Chemical Name:
Benzenamine, 4-bromo-2-iodo-5-methyl-
CAS Number:
1609264-62-1
Molecular Formula:
C7H7BrIN
Molecular Weight:
311.9457
MDL Number:
MFCD27995559
IUPAC Name:
4-bromo-2-iodo-5-methylaniline
InChI:
InChI=1S/C7H7BrIN/c1-4-2-7(10)6(9)3-5(4)8/h2-3H,10H2,1H3
InChI Key:
COSLUVOCIKOMSF-UHFFFAOYSA-N
SMILES:
Brc1cc(I)c(cc1C)N
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.881g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
311.948g/mol
Monoisotopic Mass:
310.881g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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