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874-17-9 | 2,6-Dibromo-4-chloroaniline
CAS No: 874-17-9 Catalog No: AG004JA3 MDL No:MFCD00051750
Product Description
Catalog Number:
AG004JA3
Chemical Name:
2,6-Dibromo-4-chloroaniline
CAS Number:
874-17-9
Molecular Formula:
C6H4Br2ClN
Molecular Weight:
285.3637
MDL Number:
MFCD00051750
IUPAC Name:
2,6-dibromo-4-chloroaniline
InChI:
InChI=1S/C6H4Br2ClN/c7-4-1-3(9)2-5(8)6(4)10/h1-2H,10H2
InChI Key:
XEYLQXUJSOJWJV-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)c(c(c1)Br)N
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.838g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.363g/mol
Monoisotopic Mass:
282.84g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| 2,6-Dibromo-4-chloro-aniline. | Acta crystallographica. Section E, Structure reports online 20120601 |
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