2-Hydroxy-2-azaadamantane - CAS 1155843-79-0
Catalog: |
BB063589 |
Product Name: |
2-Hydroxy-2-azaadamantane |
CAS: |
1155843-79-0 |
Synonyms: |
AZADOL; 2-Hydroxy-2-azatricyclo[3.3.1.13,7]decane; N-Hydroxy-2-azaadamantane |
IUPAC Name: | 2-hydroxy-2-azatricyclo[3.3.1.13,7]decane |
Description: | 2-Hydroxy-2-azaadamantane is a catalysis for the efficient C(sp3)-H bond functionalization of Isochroman. |
Molecular Weight: | 153.22 |
Molecular Formula: | C9H15NO |
Canonical SMILES: | C1C2CC3CC1CC(C2)N3O |
InChI: | InChI=1S/C9H15NO/c11-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-9,11H,1-5H2 |
InChI Key: | SFXINVPZIZMFHM-UHFFFAOYSA-N |
References: | Muramatsu, W., et al. Org. Lett., 17, 1549-1552 (2015). |
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 |
Complexity: | 152 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.115364102 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 23.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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