2-Amino-3,5-dichlorobenzonitrile - CAS 36764-94-0
Catalog: |
BB023067 |
Product Name: |
2-Amino-3,5-dichlorobenzonitrile |
CAS: |
36764-94-0 |
Synonyms: |
2-amino-3,5-dichlorobenzonitrile |
IUPAC Name: | 2-amino-3,5-dichlorobenzonitrile |
Description: | 2-Amino-3,5-dichlorobenzonitrile (CAS# 36764-94-0) is a useful research chemical used in the preparation of N-Chloro-N-methoxybenzenesulfonamide, a chlorinating agent. |
Molecular Weight: | 187.03 |
Molecular Formula: | C7H4Cl2N2 |
Canonical SMILES: | C1=C(C=C(C(=C1Cl)N)C#N)Cl |
InChI: | InChI=1S/C7H4Cl2N2/c8-5-1-4(3-10)7(11)6(9)2-5/h1-2H,11H2 |
InChI Key: | ZHKNDJRPOVUPMT-UHFFFAOYSA-N |
Boiling Point: | 284.7 ℃ at 760 mmHg |
Melting Point: | 123-127 ℃ (lit.) |
Purity: | 95 % |
Density: | 1.48 g/cm3 |
Appearance: | White to light yellow crystal |
MDL: | MFCD00158947 |
LogP: | 3.02848 |
GHS Hazard Statement: | H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
DE-102018201548-A1 | Electrolytic composition for electrochemical cell for high temperature applications | 20180201 |
WO-2019149812-A1 | Electrolyte composition for electrochemical cell for high-temperature applications | 20180201 |
US-10240084-B2 | Non-crystallizable pi-conjugated molecular glass mixtures, charge transporting molecular glass mixtures, luminescent molecular glass mixtures, or combinations thereof for organic light emitting diodes and other organic electronics and photonics applications | 20140325 |
US-2015275076-A1 | Non-crystallizable Pi-conjugated Molecular Glass Mixtures, Charge Transporting Molecular Glass Mixtures, Luminescent Molecular Glass Mixtures, or Combinations Thereof for Organic Light Emitting Diodes and other Organic Electronics and Photonics Applications | 20140325 |
US-2015011628-A1 | Substitute diphenylamine compounds use thereof as antitumor agents | 20120314 |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.9751535 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.9751535 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 49.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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Related Functional Groups
Amines and Anilines
Nitrogen Compounds
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