3,5-Dibromo-4-fluorobenzoic Acid - CAS 402-87-9
Catalog: |
BB024430 |
Product Name: |
3,5-Dibromo-4-fluorobenzoic Acid |
CAS: |
402-87-9 |
Synonyms: |
3,5-dibromo-4-fluorobenzoic acid; 3,5-dibromo-4-fluorobenzoic acid |
IUPAC Name: | 3,5-dibromo-4-fluorobenzoic acid |
Description: | 3,5-Dibromo-4-fluorobenzoic Acid (CAS# 402-87-9 ) is a useful research chemical. |
Molecular Weight: | 297.90 |
Molecular Formula: | C7H3Br2FO2 |
Canonical SMILES: | C1=C(C=C(C(=C1Br)F)Br)C(=O)O |
InChI: | InChI=1S/C7H3Br2FO2/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,(H,11,12) |
InChI Key: | URZMIPMWYXHUMI-UHFFFAOYSA-N |
LogP: | 3.04890 |
Publication Number | Title | Priority Date |
CN-111825677-A | Selective NK-3 receptor antagonist and preparation and application thereof | 20190419 |
WO-2005063385-A1 | Method for oxidizing saturated hydrocarbons | 20031219 |
CA-2430171-A1 | Preparation of aromatic and heteroaromatic carboxylic acids by catalytic ozonolysis | 20020515 |
EP-1362840-A1 | Process for the preparation of aromatic and heteroaromatic carboxylic acids via catalytic ozonolysis | 20020515 |
JP-2003335724-A | Process for producing aromatic and heteroaromatic carboxylic acids by catalytic ozonolysis | 20020515 |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 297.84633 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 295.84838 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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