6-Bromonaphthalene-2-sulfonic Acid - CAS 57189-62-5
Catalog: |
BB029604 |
Product Name: |
6-Bromonaphthalene-2-sulfonic Acid |
CAS: |
57189-62-5 |
Synonyms: |
6-bromo-2-naphthalenesulfonic acid; 6-bromonaphthalene-2-sulfonic acid |
IUPAC Name: | 6-bromonaphthalene-2-sulfonic acid |
Description: | 6-Bromonaphthalene-2-sulfonic Acid (CAS# 57189-62-5 ) is a useful research chemical. |
Molecular Weight: | 287.13 |
Molecular Formula: | C10H7BrO3S |
Canonical SMILES: | C1=CC2=C(C=CC(=C2)Br)C=C1S(=O)(=O)O |
InChI: | InChI=1S/C10H7BrO3S/c11-9-3-1-8-6-10(15(12,13)14)4-2-7(8)5-9/h1-6H,(H,12,13,14) |
InChI Key: | WETKSLNBZAJSRO-UHFFFAOYSA-N |
LogP: | 3.92980 |
Publication Number | Title | Priority Date |
EP-1684744-A2 | Pyrrolidine and piperidine derivatives as factor xa inhibitors | 20031001 |
EP-1684744-A4 | PYRROLIDINE AND PIPERIDINE DERIVATIVES AS FACTOR XA INHIBITORS | 20031001 |
US-2005119266-A1 | Pyrrolidine and piperidine derivatives as factor Xa inhibitors | 20031001 |
WO-2005032472-A2 | Pyrrolidine and piperidine derivatives as factor xa inhibitors | 20031001 |
EP-1667635-A2 | Sulfonylaminovalerolactams and derivatives thereof as factor xa inhibitors | 20030930 |
Complexity: | 322 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 285.92993 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 285.92993 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 62.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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