2-Chloro-3-nitrobenzamide - CAS 117054-76-9
Catalog: |
BB003839 |
Product Name: |
2-Chloro-3-nitrobenzamide |
CAS: |
117054-76-9 |
Synonyms: |
2-chloro-3-nitrobenzamide; 2-chloro-3-nitrobenzamide |
IUPAC Name: | 2-chloro-3-nitrobenzamide |
Description: | 2-Chloro-3-nitrobenzamide (CAS# 117054-76-9 ) is a useful research chemical. |
Molecular Weight: | 200.58 |
Molecular Formula: | C7H5ClN2O3 |
Canonical SMILES: | C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)C(=O)N |
InChI: | InChI=1S/C7H5ClN2O3/c8-6-4(7(9)11)2-1-3-5(6)10(12)13/h1-3H,(H2,9,11) |
InChI Key: | YKTHIYUTPYYKGA-UHFFFAOYSA-N |
LogP: | 2.75450 |
Publication Number | Title | Priority Date |
CN-110016025-A | A kind of immunomodulator | 20180108 |
CN-110072842-A | Molecule and relative intermediate, composition and method with desinsection effectiveness | 20161012 |
CN-109071514-A | Heterocycleamide as protein modulator | 20160407 |
CN-109608443-A | Heterocycleamide as protein modulator | 20160407 |
CN-103936719-A | Preparation method and application of benzimidazoles derivatives | 20140514 |
Complexity: | 228 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.9988697 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.9988697 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 88.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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