(1R,2R,7R,7aS)-1-Azido-7-chlorohexahydro-1H-pyrrolizin-2-ol - CAS 1315552-05-6
Catalog: |
BB061534 |
Product Name: |
(1R,2R,7R,7aS)-1-Azido-7-chlorohexahydro-1H-pyrrolizin-2-ol |
CAS: |
1315552-05-6 |
Synonyms: |
(1R,2R,7R,7aS)-1-Azido-7-chlorohexahydro-1H-pyrrolizin-2-ol; (1R,2R,7R,8S)-1-azido-7-chloro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-2-ol; (1R,2R,7R,7aS)-1-azido-7-chloro-hexahydro-1H-pyrrolizin-2-ol |
IUPAC Name: | (1R,2R,7R,8S)-1-azido-7-chloro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-2-ol |
Description: | (1R,2R,7R,7aS)-1-Azido-7-chlorohexahydro-1H-pyrrolizin-2-ol is an intermediate in the synthesis of Loline (I707255), an alkaloid isolated from fungal endophytes, an endosymbiont that lives within a plant. |
Molecular Weight: | 202.64 |
Molecular Formula: | C7H11ClN4O |
Canonical SMILES: | C1CN2CC(C(C2C1Cl)N=[N+]=[N-])O |
InChI: | InChI=1S/C7H11ClN4O/c8-4-1-2-12-3-5(13)6(7(4)12)10-11-9/h4-7,13H,1-3H2/t4-,5-,6+,7-/m1/s1 |
InChI Key: | MPRUEENYZUXHRP-MVIOUDGNSA-N |
Solubility: | DCM, Methanol |
Appearance: | Pale Yellow Solids |
References: | Cakmak, M., et al. Nature. Chem., 3, 543 (2011). |
Complexity: | 255 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 4 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.0621387 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.0621387 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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