4-Chloro-2-(trifluoromethyl)quinoline - CAS 1701-24-2
Catalog: |
BB012614 |
Product Name: |
4-Chloro-2-(trifluoromethyl)quinoline |
CAS: |
1701-24-2 |
Synonyms: |
4-chloro-2-(trifluoromethyl)quinoline |
IUPAC Name: | 4-chloro-2-(trifluoromethyl)quinoline |
Description: | 4-Chloro-2-(trifluoromethyl)quinoline (CAS# 1701-24-2) is a useful research chemical. |
Molecular Weight: | 231.60 |
Molecular Formula: | C10H5ClF3N |
Canonical SMILES: | C1=CC=C2C(=C1)C(=CC(=N2)C(F)(F)F)Cl |
InChI: | InChI=1S/C10H5ClF3N/c11-7-5-9(10(12,13)14)15-8-4-2-1-3-6(7)8/h1-5H |
InChI Key: | ONNDFDQMHCNEGF-UHFFFAOYSA-N |
Boiling Point: | 236.4 ℃ at 760 mmHg |
Melting Point: | 31-33 ℃ |
Purity: | 95 % |
Density: | 1.427 g/cm3 |
MDL: | MFCD00153105 |
LogP: | 3.90700 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-20210057680-A | Novel quinoline compounds and uses thereof | 20191111 |
WO-2021096335-A1 | Novel quinoline compound and use thereof | 20191111 |
CN-109608435-A | Quinoline substituent indole compound, preparation method and the usage | 20181130 |
KR-20190137014-A | Heterocyclic derivatives and use thereof | 20180531 |
WO-2019231271-A1 | Heterocyclic derivatives and use thereof | 20180531 |
Complexity: | 231 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.0062613 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 231.0062613 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4 |
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Quinoline/Isoquinoline
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