tert-Butyl 5-hydroxyoctahydro-2H-isoindole-2-carboxylate - CAS 203661-67-0
Catalog: |
BB057633 |
Product Name: |
tert-Butyl 5-hydroxyoctahydro-2H-isoindole-2-carboxylate |
CAS: |
203661-67-0 |
Synonyms: |
1,1-Dimethylethyl octahydro-5-hydroxy-2H-isoindole-2-carboxylate |
IUPAC Name: | tert-butyl 5-hydroxy-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboxylate |
Description: | tert-Butyl 5-hydroxyoctahydro-2H-isoindole-2-carboxylate is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 241.33 |
Molecular Formula: | C13H23NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC2CCC(CC2C1)O |
InChI: | InChI=1S/C13H23NO3/c1-13(2,3)17-12(16)14-7-9-4-5-11(15)6-10(9)8-14/h9-11,15H,4-8H2,1-3H3 |
InChI Key: | ISZLPPFTZXTGHT-UHFFFAOYSA-N |
References: | Kaneko, T., et al. From PCT Int. Appl. (1998), WO 9806720 A1 19980219; Zhang, J., et al. From PCT Int. Appl. (2017), WO 2017118294 A1 20170713. |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/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 |
EP-3401315-A1 | Fxr receptor modulator, preparation method therefor, and uses thereof | 20160106 |
US-2019002452-A1 | Fxr receptor modulator, preparation method therefor, and uses thereof | 20160106 |
WO-2017118294-A1 | Fxr receptor modulator, preparation method therefor, and uses thereof | 20160106 |
EP-3122729-A1 | Substituted heteroaryl compounds and methods of use | 20140328 |
EP-3312164-A1 | Substituted heteroaryl compounds and methods of use | 20140328 |
JP-2017510642-A | Substituted heteroaryl compounds and methods of use | 20140328 |
JP-6517318-B2 | Substituted heteroaryl compounds and methods of use | 20140328 |
US-2015274704-A1 | Substituted heteroaryl compounds and methods of use | 20140328 |
US-9403801-B2 | Substituted heteroaryl compounds and methods of use | 20140328 |
WO-2015148867-A1 | Substituted heteroaryl compounds and methods of use | 20140328 |
Complexity: | 298 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.1677936 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.1677936 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.8Ų |
Undefined Atom Stereocenter Count: | 3 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
-
[57166-92-4]
Methylenediamine dihydrochloride
-
[1118-71-4]
2,2,6,6-Tetramethyl-3,5-heptanedione
-
[875573-66-3]
Estra-1,3,5(10)-triene-3,17-diol,7-(9-bromononyl)-,17-acetate,(7a,17b)-
-
[30360-19-1]
N,N'-Diethyl-N''-isopropyl-1,3,5-triazine-2,4,6-triamine
-
[35045-02-4]
Metribuzin-desamino
-
[1984-15-2]
Methylenediphosphonic acid
INDUSTRY LEADERS TRUST OUR PRODUCTS