3-(2-Chloroethyl)-2,7-dichloroquinoline - CAS 948294-54-0
Catalog: |
BB041555 |
Product Name: |
3-(2-Chloroethyl)-2,7-dichloroquinoline |
CAS: |
948294-54-0 |
Synonyms: |
2,7-dichloro-3-(2-chloroethyl)quinoline |
IUPAC Name: | 2,7-dichloro-3-(2-chloroethyl)quinoline |
Description: | 3-(2-Chloroethyl)-2,7-dichloroquinoline (CAS# 948294-54-0) is a useful research chemical. |
Molecular Weight: | 260.55 |
Molecular Formula: | C11H8Cl3N |
Canonical SMILES: | C1=CC(=CC2=NC(=C(C=C21)CCCl)Cl)Cl |
InChI: | InChI=1S/C11H8Cl3N/c12-4-3-8-5-7-1-2-9(13)6-10(7)15-11(8)14/h1-2,5-6H,3-4H2 |
InChI Key: | UCRSISKIOWPLSD-UHFFFAOYSA-N |
Boiling Point: | 378.9 ℃ at 760 mmHg |
Density: | 1.409 g/cm3 |
LogP: | 4.32290 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P264, P264+P265, P270, P273, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 |
Signal Word: | Danger |
Complexity: | 212 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.972232 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.972232 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.6 |
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Related Functional Groups
Quinoline/Isoquinoline
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