5-Bromo-2,3-dihydro-1H-inden-2-ol - CAS 862135-61-3
Catalog: |
BB037857 |
Product Name: |
5-Bromo-2,3-dihydro-1H-inden-2-ol |
CAS: |
862135-61-3 |
Synonyms: |
5-bromo-2,3-dihydro-1H-inden-2-ol; 5-bromo-2,3-dihydro-1H-inden-2-ol |
IUPAC Name: | 5-bromo-2,3-dihydro-1H-inden-2-ol |
Description: | 5-Bromo-2,3-dihydro-1H-inden-2-ol (CAS# 862135-61-3) is a useful research chemical. |
Molecular Weight: | 213.07 |
Molecular Formula: | C9H9BrO |
Canonical SMILES: | C1C(CC2=C1C=CC(=C2)Br)O |
InChI: | InChI=1S/C9H9BrO/c10-8-2-1-6-4-9(11)5-7(6)3-8/h1-3,9,11H,4-5H2 |
InChI Key: | QYVONEHTDRTAHN-UHFFFAOYSA-N |
Boiling Point: | 299.6 ℃ at 760 mmHg |
Density: | 1.617 g/cm3 |
MDL: | MFCD12755975 |
LogP: | 1.90860 |
Publication Number | Title | Priority Date |
WO-2021105117-A1 | Substituted aminoquinolones as dgkalpha inhibitors for immune activation | 20191128 |
EP-3394061-A1 | 6,7-dihydro-5h-pyrrolo[3,4-b]pyridin-5-one allosteric modulators of the m4 muscarinic acetylcholine receptor | 20151223 |
EP-3394061-B1 | 6,7-dihydro-5h-pyrrolo[3,4-b]pyridin-5-one allosteric modulators of the m4 muscarinic acetylcholine receptor | 20151223 |
US-10329289-B2 | 6,7-dihydro-5H-pyrrolo[3,4-B]pyridin-5-one allosteric modulators of the M4 muscarinic acetylcholine receptor | 20151223 |
US-10351564-B2 | 6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one allosteric modulators of the M4 muscarinic acetylcholine receptor | 20151223 |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.98368 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.98368 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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