2-Iodo-6-methyl-4-nitroaniline - CAS 220144-91-2
Catalog: |
BB017277 |
Product Name: |
2-Iodo-6-methyl-4-nitroaniline |
CAS: |
220144-91-2 |
Synonyms: |
2-iodo-6-methyl-4-nitroaniline; 2-iodo-6-methyl-4-nitroaniline |
IUPAC Name: | 2-iodo-6-methyl-4-nitroaniline |
Description: | 2-Iodo-6-methyl-4-nitroaniline (CAS# 220144-91-2) is a useful research chemical. |
Molecular Weight: | 278.05 |
Molecular Formula: | C7H7IN2O2 |
Canonical SMILES: | CC1=CC(=CC(=C1N)I)[N+](=O)[O-] |
InChI: | InChI=1S/C7H7IN2O2/c1-4-2-5(10(11)12)3-6(8)7(4)9/h2-3H,9H2,1H3 |
InChI Key: | DFWFGNCVGITLCM-UHFFFAOYSA-N |
Boiling Point: | 388.7 ℃ at 760 mmHg |
Density: | 1.959 g/cm3 |
LogP: | 3.19440 |
Publication Number | Title | Priority Date |
EP-3154976-A2 | Purine inhibitors of human phosphatidylinositol 3-kinase delta | 20140613 |
EP-3154976-B1 | Purine inhibitors of human phosphatidylinositol 3-kinase delta | 20140613 |
US-10100064-B2 | Purine inhibitors of human phosphatidylinositol 3-kinase delta | 20140613 |
US-2017114078-A1 | Purine inhibitors of human phosphatidylinositol 3-kinase delta | 20140613 |
WO-2015188369-A1 | Purine inhibitors of human phosphatidylinositol 3-kinase delta | 20140613 |
Complexity: | 183 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 277.95523 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 277.95523 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 71.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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Amines and Anilines
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