2-Chloro-4-(trifluoromethoxy)aniline - CAS 69695-61-0
Catalog: |
BB033931 |
Product Name: |
2-Chloro-4-(trifluoromethoxy)aniline |
CAS: |
69695-61-0 |
Synonyms: |
2-chloro-4-(trifluoromethoxy)aniline |
IUPAC Name: | 2-chloro-4-(trifluoromethoxy)aniline |
Description: | 2-Chloro-4-(trifluoromethoxy)aniline (CAS# 69695-61-0) is a useful research chemical. |
Molecular Weight: | 211.57 |
Molecular Formula: | C7H5ClF3NO |
Canonical SMILES: | C1=CC(=C(C=C1OC(F)(F)F)Cl)N |
InChI: | InChI=1S/C7H5ClF3NO/c8-5-3-4(1-2-6(5)12)13-7(9,10)11/h1-3H,12H2 |
InChI Key: | YMLWONHDNGICOH-UHFFFAOYSA-N |
Boiling Point: | 94-96 ℃ (11 mmHg) |
Density: | 1.524 g/cm3 |
MDL: | MFCD01631704 |
LogP: | 3.40200 |
GHS Hazard Statement: | H302 (97.56%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P280, P285, P301+P312, P304+P341, P305+P351+P338, P330, P337+P313, P342+P311, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113130772-A | Nanocomposite material, preparation method thereof, solution composition and light emitting diode | 20191230 |
CN-110590576-A | Preparation method of 4-polyfluoro methoxy o-phenylenediamine | 20190815 |
CA-2951349-A1 | Fused bicyclic heteroaromatic derivatives as kinase inhibitors | 20140617 |
CN-106559992-A | As the bicyclic heteroaromatic derivative for condensing of kinase inhibitor | 20140617 |
EP-3157924-A1 | Fused bicyclic heteroaromatic derivatives as kinase inhibitors | 20140617 |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.0011760 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.0011760 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 35.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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