2-(4-Bromophenyl)-1,1,1,3,3,3-hexafluoro-2-propanol - CAS 2402-72-4
Catalog: |
BB018292 |
Product Name: |
2-(4-Bromophenyl)-1,1,1,3,3,3-hexafluoro-2-propanol |
CAS: |
2402-72-4 |
Synonyms: |
2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoro-2-propanol; 2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol |
IUPAC Name: | 2-(4-bromophenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol |
Description: | 2-(4-Bromophenyl)-1,1,1,3,3,3-hexafluoro-2-propanol (CAS# 2402-72-4 ) is a useful research chemical. |
Molecular Weight: | 323.03 |
Molecular Formula: | C9H5BrF6O |
Canonical SMILES: | C1=CC(=CC=C1C(C(F)(F)F)(C(F)(F)F)O)Br |
InChI: | InChI=1S/C9H5BrF6O/c10-6-3-1-5(2-4-6)7(17,8(11,12)13)9(14,15)16/h1-4,17H |
InChI Key: | PRQQUQLCNCIJTF-UHFFFAOYSA-N |
LogP: | 3.76130 |
Publication Number | Title | Priority Date |
WO-2020045214-A1 | Resin composition and cured film obtained therefrom | 20180831 |
CN-106061971-A | Pyrrolidinyl sulfone derivatives and their use as ROR gamma modulators | 20140106 |
CN-106061971-B | Pyrrolidinyl sulfone derivative and its purposes as ROR gamma modulators | 20140106 |
EA-030849-B1 | PYRROLIDINYL SULFONE RORγ MODULATORS | 20140106 |
EP-3092229-A1 | Pyrrolidinyl sulfone derivatives and their use as ror gamma modulators | 20140106 |
Complexity: | 252 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 321.9428 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 321.9428 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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