2-(Chloromethyl)quinoline hydrochloride - CAS 3747-74-8
Catalog: |
BB023299 |
Product Name: |
2-(Chloromethyl)quinoline hydrochloride |
CAS: |
3747-74-8 |
Synonyms: |
2-(chloromethyl)quinoline;hydrochloride |
IUPAC Name: | 2-(chloromethyl)quinoline;hydrochloride |
Description: | 2-(Chloromethyl)quinoline hydrochloride (CAS# 3747-74-8) is a substituted Quinoline building block for the synthesis of various pharmaceutical and biologically active compounds. It can also be used for the preparation of Quinoline-based fluorescent zinc sensors, used as fluorescent probes. |
Molecular Weight: | 214.09 |
Molecular Formula: | C10H8ClN · HCl |
Canonical SMILES: | C1=CC=C2C(=C1)C=CC(=N2)CCl.Cl |
InChI: | InChI=1S/C10H8ClN.ClH/c11-7-9-6-5-8-3-1-2-4-10(8)12-9;/h1-6H,7H2;1H |
InChI Key: | WDETYCRYUBGKCE-UHFFFAOYSA-N |
Boiling Point: | 288.8 °C at 760 mmHg |
Purity: | > 98.0 % (T) |
Density: | 1.229 g/cm3 |
Appearance: | Pale yellow to cream or light pink powder |
MDL: | MFCD00012734 |
LogP: | 3.77560 |
GHS Hazard Statement: | H302 (88.37%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P310, P321, P330, P332+P313, P333+P313, P362, P363, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2020247804-A1 | Heterocycle substituted pyridine derivative antifungal agents | 20190607 |
WO-2020146822-A1 | Leukotriene synthesis inhibitors | 20190111 |
AU-2018379077-A1 | Heterocycle substituted pyridine derivative antifungal agents | 20171207 |
WO-2019113542-A1 | Heterocycle substituted pyridine derivative antifungal agents | 20171207 |
BR-112020011162-A2 | heterocycle-substituted pyridine-derived antifungal agents | 20171207 |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 213.0112047 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 213.0112047 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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Quinoline/Isoquinoline
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