4-Bromoisoindoline hydrochloride - CAS 923590-95-8
Catalog: |
BB040497 |
Product Name: |
4-Bromoisoindoline hydrochloride |
CAS: |
923590-95-8 |
Synonyms: |
4-bromo-2,3-dihydro-1H-isoindole;hydrochloride |
IUPAC Name: | 4-bromo-2,3-dihydro-1H-isoindole;hydrochloride |
Description: | 4-Bromoisoindoline hydrochloride (CAS# 923590-95-8) is used in preparation of of Isoindolines as HDAC inhibitors. |
Molecular Weight: | 234.52 |
Molecular Formula: | C8H8BrN · HCl |
Canonical SMILES: | C1C2=C(CN1)C(=CC=C2)Br.Cl |
InChI: | InChI=1S/C8H8BrN.ClH/c9-8-3-1-2-6-4-10-5-7(6)8;/h1-3,10H,4-5H2;1H |
InChI Key: | FQHLHVFOJBANKY-UHFFFAOYSA-N |
Purity: | 95 % |
Appearance: | Solid |
MDL: | MFCD10700134 |
LogP: | 3.31410 |
GHS Hazard Statement: | H315 (97.56%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021207682-A2 | Pi3 kinase inhibitors and uses thereof | 20200409 |
WO-2021081528-A1 | Selective neuronal nitric oxide synthase inhibitors | 20191025 |
WO-2020191022-A1 | Inhibiting ubiquitin specific peptidase 9x | 20190318 |
WO-2021055668-A1 | Inhibiting ubiquitin specific peptidase 9x | 20190318 |
WO-2020139916-A1 | Inhibiting ubiquitin specific peptidase 9x | 20181226 |
Complexity: | 126 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 232.96069 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 232.96069 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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Indolines
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