3-Bromo-2-fluoroanisole - CAS 295376-21-5
Catalog: |
BB020232 |
Product Name: |
3-Bromo-2-fluoroanisole |
CAS: |
295376-21-5 |
Synonyms: |
1-bromo-2-fluoro-3-methoxybenzene; 1-bromo-2-fluoro-3-methoxybenzene |
IUPAC Name: | 1-bromo-2-fluoro-3-methoxybenzene |
Description: | 3-Bromo-2-fluoroanisole (CAS# 295376-21-5) is a useful research chemical. |
Molecular Weight: | 205.02 |
Molecular Formula: | C7H6BrFO |
Canonical SMILES: | COC1=C(C(=CC=C1)Br)F |
InChI: | InChI=1S/C7H6BrFO/c1-10-6-4-2-3-5(8)7(6)9/h2-4H,1H3 |
InChI Key: | USVPQAWBFVANTN-UHFFFAOYSA-N |
Boiling Point: | 207.2 °C at 760 mmHg |
Density: | 1.531 g/cm3 |
MDL: | MFCD07780183 |
LogP: | 2.59680 |
Publication Number | Title | Priority Date |
CN-110669014-A | Preparation method of oxalagogri intermediate | 20191114 |
CN-112409223-A | Amide compounds and medical application thereof as STING inhibitor | 20191012 |
WO-2021068950-A1 | Amide compound and medical use thereof as sting inhibitor | 20191012 |
WO-2021043322-A1 | Azepino pyrimidine derivatives and medical use thereof | 20190906 |
US-2021002229-A1 | Compounds for treatment of pd-l1 diseases | 20190620 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.95861 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.95861 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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