Ethyl 3-(Trifluoromethyl)benzoate - CAS 76783-59-0
Catalog: |
BB035699 |
Product Name: |
Ethyl 3-(Trifluoromethyl)benzoate |
CAS: |
76783-59-0 |
Synonyms: |
3-(trifluoromethyl)benzoic acid ethyl ester; ethyl 3-(trifluoromethyl)benzoate |
IUPAC Name: | ethyl 3-(trifluoromethyl)benzoate |
Description: | Ethyl 3-(Trifluoromethyl)benzoate (CAS# 76783-59-0) is a useful research chemical. |
Molecular Weight: | 218.17 |
Molecular Formula: | C10H9F3O2 |
Canonical SMILES: | CCOC(=O)C1=CC(=CC=C1)C(F)(F)F |
InChI: | InChI=1S/C10H9F3O2/c1-2-15-9(14)7-4-3-5-8(6-7)10(11,12)13/h3-6H,2H2,1H3 |
InChI Key: | MHNBTKIAHHECCQ-UHFFFAOYSA-N |
Boiling Point: | 228.5 °C at 760 mmHg |
Density: | 1.23 g/cm3 |
Solubility: | Slightly soluble |
Appearance: | Liquid |
MDL: | MFCD00013560 |
LogP: | 2.88210 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110272344-A | A kind of camphoryl imidazole type ion liquid and its preparation method and application | 20190715 |
US-2018080314-A1 | Method of allocating individual oil or water production contributions from multiple combined sources | 20160921 |
WO-2018057219-A1 | Method of allocating individual oil or water production contributions from multiple combined sources | 20160921 |
CN-104817418-A | Synthesis method for carboxylic acid or ester compound | 20150316 |
CN-104817418-B | A kind of carboxylic acid or the synthetic method of ester type compound | 20150316 |
Complexity: | 225 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 218.05546401 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 218.05546401 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
-
[2555-49-9]
Ethyl phenoxyacetate
-
[155180-53-3]
RU-59063
-
[6315-52-2]
Ethylene di(p-toluenesulfonate)
-
[1427004-19-0]
DBCO-PEG4-NHS ester
-
[132182-92-4]
Pentane, 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)-
-
[133407-82-6]
MG-132
INDUSTRY LEADERS TRUST OUR PRODUCTS