3-Bromo-2-chlorobenzotrifluoride - CAS 56131-47-6
Catalog: |
BB029268 |
Product Name: |
3-Bromo-2-chlorobenzotrifluoride |
CAS: |
56131-47-6 |
Synonyms: |
1-bromo-2-chloro-3-(trifluoromethyl)benzene; 1-bromo-2-chloro-3-(trifluoromethyl)benzene |
IUPAC Name: | 1-bromo-2-chloro-3-(trifluoromethyl)benzene |
Description: | 3-Bromo-2-chlorobenzotrifluoride (CAS# 56131-47-6) is a useful research chemical. |
Molecular Weight: | 259.45 |
Molecular Formula: | C7H3BrClF3 |
Canonical SMILES: | C1=CC(=C(C(=C1)Br)Cl)C(F)(F)F |
InChI: | InChI=1S/C7H3BrClF3/c8-5-3-1-2-4(6(5)9)7(10,11)12/h1-3H |
InChI Key: | DWTJMEQXGJMZMM-UHFFFAOYSA-N |
Boiling Point: | 207.7 °C at 760 mmHg |
Density: | 1.717 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD04115994 |
LogP: | 4.12130 |
Publication Number | Title | Priority Date |
CN-110002989-A | A kind of preparation method of the bromo- 2- chlorobenzoic acid of highly selective 5- | 20190315 |
CN-108250060-A | The synthetic method of the bromo- 2- chlorobenzoic acids of 5- | 20180126 |
CN-106674200-B | A kind of compound and its preparation method and application containing L- prolineamide segment | 20161221 |
CN-105622382-A | Synthesis method of 5-bromo-2-chloro benzoic acid | 20160223 |
CN-105622382-B | A kind of synthetic method of the bromo- 2- chlorobenzoic acids of 5- | 20160223 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.90587 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.90587 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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