3-(Trifluoromethoxy)benzoyl chloride - CAS 86270-03-3
Catalog: |
BB037877 |
Product Name: |
3-(Trifluoromethoxy)benzoyl chloride |
CAS: |
86270-03-3 |
Synonyms: |
3-(trifluoromethoxy)benzoyl chloride |
IUPAC Name: | 3-(trifluoromethoxy)benzoyl chloride |
Description: | 3-(Trifluoromethoxy)benzoyl chloride (CAS# 86270-03-3) is a useful research chemical. |
Molecular Weight: | 224.56 |
Molecular Formula: | C8H4ClF3O2 |
Canonical SMILES: | C1=CC(=CC(=C1)OC(F)(F)F)C(=O)Cl |
InChI: | InChI=1S/C8H4ClF3O2/c9-7(13)5-2-1-3-6(4-5)14-8(10,11)12/h1-4H |
InChI Key: | MGKIOAXLPYJSMU-UHFFFAOYSA-N |
Boiling Point: | 204.1 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.43 g/cm3 |
Appearance: | Liquid |
MDL: | MFCD00061268 |
LogP: | 2.96420 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-109928967-B | Cyclized berberine derivative and preparation method and application thereof | 20171128 |
KR-20200026987-A | Carboxamides as Modulators of Sodium Channels | 20170711 |
US-2019151303-A1 | Quinolines that modulate serca and their use for treating disease | 20170227 |
US-10772881-B2 | Quinolines that modulate SERCA and their use for treating disease | 20170227 |
US-2018251489-A1 | Malt1 inhibitors and uses thereof | 20150828 |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.9851915 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.9851915 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.2 |
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