4-(Methylamino)cyclohexanone 2,2-dimethyltrimethylene ketal hydrochloride - CAS 158747-10-5
Catalog: |
BB011461 |
Product Name: |
4-(Methylamino)cyclohexanone 2,2-dimethyltrimethylene ketal hydrochloride |
CAS: |
158747-10-5 |
Synonyms: |
N,3,3-trimethyl-1,5-dioxaspiro[5.5]undecan-9-amine;hydrochloride |
IUPAC Name: | N,3,3-trimethyl-1,5-dioxaspiro[5.5]undecan-9-amine;hydrochloride |
Description: | 4-(Methylamino)cyclohexanone 2,2-dimethyltrimethylene ketal hydrochloride (CAS# 158747-10-5) is a useful research chemical. |
Molecular Weight: | 249.78 |
Molecular Formula: | C12H23NO2·HCl |
Canonical SMILES: | CC1(COC2(CCC(CC2)NC)OC1)C.Cl |
InChI: | InChI=1S/C12H23NO2.ClH/c1-11(2)8-14-12(15-9-11)6-4-10(13-3)5-7-12;/h10,13H,4-9H2,1-3H3;1H |
InChI Key: | SUTDEUGEHVLMEF-UHFFFAOYSA-N |
MDL: | MFCD01863581 |
LogP: | 3.11060 |
Publication Number | Title | Priority Date |
WO-2019233745-A1 | Novel compounds for the treatment, alleviation or prevention of disorders associated with tau aggregates | 20180604 |
EP-3802528-A1 | Novel compounds for the treatment, alleviation or prevention of disorders associated with tau aggregates | 20180604 |
US-2021214371-A1 | Novel Compounds for the Treatment, Alleviation or Prevention of Disorders Associated with Tau Aggregates | 20180604 |
AU-2011239966-A1 | Novel compounds for the treatment of diseases associated with amyloid or amyloid-like proteins | 20100416 |
AU-2011239966-B2 | Novel compounds for the treatment of diseases associated with amyloid or amyloid-like proteins | 20100416 |
Complexity: | 208 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.1495567 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.1495567 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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