2,6-Dimethoxyphenyl trifluoromethanesulfonate - CAS 60319-07-5
Catalog: |
BB030653 |
Product Name: |
2,6-Dimethoxyphenyl trifluoromethanesulfonate |
CAS: |
60319-07-5 |
Synonyms: |
(2,6-dimethoxyphenyl) trifluoromethanesulfonate |
IUPAC Name: | (2,6-dimethoxyphenyl) trifluoromethanesulfonate |
Description: | 2,6-Dimethoxyphenyl trifluoromethanesulfonate (CAS# 60319-07-5 ) is a useful research chemical. |
Molecular Weight: | 286.22 |
Molecular Formula: | C9H9F3O5S |
Canonical SMILES: | COC1=C(C(=CC=C1)OC)OS(=O)(=O)C(F)(F)F |
InChI: | InChI=1S/C9H9F3O5S/c1-15-6-4-3-5-7(16-2)8(6)17-18(13,14)9(10,11)12/h3-5H,1-2H3 |
InChI Key: | MMOZMBDXJRPZLZ-UHFFFAOYSA-N |
Boiling Point: | 115 °C / 0.2 mmHg (lit.) |
Density: | 1.376 g/mL at 25 °C(lit.) |
MDL: | MFCD06411304 |
LogP: | 3.01300 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110556509-A | Method for performing surface protection and passivation treatment on metallic lithium cathode by using fluorine-containing organic matter, product and application | 20190814 |
WO-2017087659-A1 | Liquid crystal sensor | 20151118 |
US-2020409221-A1 | Liquid crystal sensor | 20151118 |
US-2016018371-A1 | Detection of gas-phase analytes using liquid crystals | 20130313 |
US-2017212088-A1 | Detection of gas-phase analytes using liquid crystals | 20130313 |
Complexity: | 349 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 286.01227904 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 8 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 286.01227904 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 70.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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