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533-70-0 | 2,4-Diiodoaniline
CAS No: 533-70-0 Catalog No: AG00D9PA MDL No:MFCD01851096
Product Description
Catalog Number:
AG00D9PA
Chemical Name:
2,4-Diiodoaniline
CAS Number:
533-70-0
Molecular Formula:
C6H5I2N
Molecular Weight:
344.9195
MDL Number:
MFCD01851096
IUPAC Name:
2,4-diiodoaniline
InChI:
InChI=1S/C6H5I2N/c7-4-1-2-6(9)5(8)3-4/h1-3H,9H2
InChI Key:
YJWGKXIQTRYZSH-UHFFFAOYSA-N
SMILES:
Ic1ccc(c(c1)I)N
UNII:
NV2D8O2252
NSC Number:
508880
Properties
Complexity:
97.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.851g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.922g/mol
Monoisotopic Mass:
344.851g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| 2,4-Diiodo-aniline. | Acta crystallographica. Section E, Structure reports online 20090901 |
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