2-Chloro-1,4-bis(trifluoromethyl)benzene - CAS 328-91-6
Catalog: |
BB021466 |
Product Name: |
2-Chloro-1,4-bis(trifluoromethyl)benzene |
CAS: |
328-91-6 |
Synonyms: |
2-chloro-1,4-bis(trifluoromethyl)benzene; 2-chloro-1,4-bis(trifluoromethyl)benzene |
IUPAC Name: | 2-chloro-1,4-bis(trifluoromethyl)benzene |
Description: | 2-Chloro-1,4-bis(trifluoromethyl)benzene (CAS# 328-91-6) is a useful research chemical. |
Molecular Weight: | 248.55 |
Molecular Formula: | C8H3ClF6 |
Canonical SMILES: | C1=CC(=C(C=C1C(F)(F)F)Cl)C(F)(F)F |
InChI: | InChI=1S/C8H3ClF6/c9-6-3-4(7(10,11)12)1-2-5(6)8(13,14)15/h1-3H |
InChI Key: | IDNVTCBYGYOPKJ-UHFFFAOYSA-N |
Boiling Point: | 164.1 °C at 760 mmHg |
Density: | 1.475 g/cm3 |
MDL: | MFCD00632388 |
LogP: | 4.37760 |
Publication Number | Title | Priority Date |
EP-1914221-A1 | Process for producing biaryl compound | 20050720 |
JP-2007051130-A | Process for producing biaryl compounds | 20050720 |
JP-5125008-B2 | Process for producing biaryl compounds | 20050720 |
US-2010087680-A1 | Method for producing biaryl compound | 20050720 |
WO-2007011005-A1 | Process for producing biaryl compound | 20050720 |
Complexity: | 220 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 247.9827468 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 247.9827468 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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