6,7-Dihydro-5H-isoquinolin-8-one - CAS 21917-88-4
Catalog: |
BB017205 |
Product Name: |
6,7-Dihydro-5H-isoquinolin-8-one |
CAS: |
21917-88-4 |
Synonyms: |
6,7-dihydro-5H-isoquinolin-8-one; 6,7-dihydro-5H-isoquinolin-8-one |
IUPAC Name: | 6,7-dihydro-5H-isoquinolin-8-one |
Description: | 6,7-Dihydro-8(5H)-isoquinolinone was used in catalyst preparation in the study of origins of catalysis in nornicotine aqueous aldol reactions. |
Molecular Weight: | 147.17 |
Molecular Formula: | C9H9NO |
Canonical SMILES: | C1CC2=C(C=NC=C2)C(=O)C1 |
InChI: | InChI=1S/C9H9NO/c11-9-3-1-2-7-4-5-10-6-8(7)9/h4-6H,1-3H2 |
InChI Key: | WFZAOWUFFCIBNP-UHFFFAOYSA-N |
Boiling Point: | 266.2 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.168 g/cm3 |
LogP: | 1.60060 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-109384793-A | A kind of sulfur alcohol compound and its application with HDAC6 inhibitory activity | 20181123 |
CN-109384793-B | Thiol compound with HDAC6 inhibitory activity and application thereof | 20181123 |
AU-2018289759-A1 | Alpha, beta-unsaturated amide compound | 20170623 |
CA-3068158-A1 | .alpha.,.beta.-unsaturated amide compound | 20170623 |
CN-110770211-A | α unsaturated amide compound | 20170623 |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 147.068413911 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 147.068413911 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 30 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS