4-Amino-3-chlorobenzonitrile - CAS 21803-75-8
Catalog: |
BB017154 |
Product Name: |
4-Amino-3-chlorobenzonitrile |
CAS: |
21803-75-8 |
Synonyms: |
4-amino-3-chlorobenzonitrile |
IUPAC Name: | 4-amino-3-chlorobenzonitrile |
Description: | 4-Amino-3-chlorobenzonitrile (CAS# 21803-75-8) is a useful research chemical. |
Molecular Weight: | 152.58 |
Molecular Formula: | C7H5ClN2 |
Canonical SMILES: | C1=CC(=C(C=C1C#N)Cl)N |
InChI: | InChI=1S/C7H5ClN2/c8-6-3-5(4-9)1-2-7(6)10/h1-3H,10H2 |
InChI Key: | OREVCMGFYSUYPX-UHFFFAOYSA-N |
Boiling Point: | 277.8 ℃ at 760 mmHg |
Melting Point: | 100-102 ℃ |
Purity: | 98 % |
Density: | 1.33 g/cm3 |
Appearance: | White to light yellow crystal powder |
MDL: | MFCD00052917 |
LogP: | 2.37508 |
GHS Hazard Statement: | H301 (11.36%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021209055-A1 | Imidazolinone derivative and use thereof in medicine | 20200417 |
WO-2021183721-A1 | Fungicidal mixtures containing pyrazole derivatives. | 20200311 |
WO-2021005586-A1 | Tricyclic akr1c3 dependent kars inhibitors | 20190801 |
WO-2021014437-A1 | Process for the preparation of biphenylamines | 20190719 |
CN-111825605-A | Aryl ketone amide compound and preparation method and application thereof | 20190419 |
Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.0141259 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.0141259 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 49.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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Amines and Anilines
Nitrogen Compounds
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