2-Chloro-3-chloromethyl-7-fluoroquinoline - CAS 948291-38-1
Catalog: |
BB041531 |
Product Name: |
2-Chloro-3-chloromethyl-7-fluoroquinoline |
CAS: |
948291-38-1 |
Synonyms: |
2-chloro-3-(chloromethyl)-7-fluoroquinoline |
IUPAC Name: | 2-chloro-3-(chloromethyl)-7-fluoroquinoline |
Description: | 2-Chloro-3-chloromethyl-7-fluoroquinoline (CAS# 948291-38-1) is a useful research chemical. |
Molecular Weight: | 230.07 |
Molecular Formula: | C10H6Cl2FN |
Canonical SMILES: | C1=CC(=CC2=NC(=C(C=C21)CCl)Cl)F |
InChI: | InChI=1S/C10H6Cl2FN/c11-5-7-3-6-1-2-8(13)4-9(6)14-10(7)12/h1-4H,5H2 |
InChI Key: | FEEYLYBSAMIXIV-UHFFFAOYSA-N |
Boiling Point: | 335.7 °C at 760 mmHg |
Density: | 1.432 g/cm3 |
LogP: | 3.76610 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
AU-2007321197-A1 | Organic compounds | 20061115 |
BR-PI0718809-A2 | ORGANIC COMPOUNDS | 20061115 |
EP-2084149-A1 | Organic compounds | 20061115 |
JP-2010509388-A | Organic compounds | 20061115 |
KR-20090078352-A | Organic compounds | 20061115 |
Complexity: | 203 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.9861327 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.9861327 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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