The store will not work correctly when cookies are disabled.
Your company account is blocked and you cannot place orders. If you have questions, please contact your company administrator.
diethyl 9-azabicyclo[3.3.1]nonane-3,7-dicarboxylate - 97%, high purity , CAS No.1363380-60-2
Basic Description
Synonyms | AKOS025290191 | DTXSID301164060 | PB39085 | CS-0049616 | 1363380-60-2 | 9-Azabicyclo[3.3.1]nonane-3,7-dicarboxylic acid, 3,7-diethyl ester | diethyl 9-azabicyclo[3.3.1]nonane-3,7-dicarboxylate | diethyl9-azabicyclo[3.3.1]nonane-3,7-dicarboxylate | AS-3454 |
Specifications & Purity | ≥97% |
Shipped In | Normal |
---|
Names and Identifiers
IUPAC Name | diethyl 9-azabicyclo[3.3.1]nonane-3,7-dicarboxylate |
INCHI | InChI=1S/C14H23NO4/c1-3-18-13(16)9-5-11-7-10(14(17)19-4-2)8-12(6-9)15-11/h9-12,15H,3-8H2,1-2H3 |
InChi Key | CYOAMOAKXMVYBL-UHFFFAOYSA-N |
Canonical SMILES | CCOC(=O)C1CC2CC(CC(C1)N2)C(=O)OCC |
Isomeric SMILES | CCOC(=O)C1CC2CC(CC(C1)N2)C(=O)OCC |
Alternate CAS | 1363380-60-2 |
PubChem CID | 72208265 |
Molecular Weight | 269.34 |
---|
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight | 269.340 g/mol |
---|
XLogP3 | 1.400 |
---|
Hydrogen Bond Donor Count | 1 |
---|
Hydrogen Bond Acceptor Count | 5 |
---|
Rotatable Bond Count | 6 |
---|
Exact Mass | 269.163 Da |
---|
Monoisotopic Mass | 269.163 Da |
---|
Topological Polar Surface Area | 64.599 Ų |
---|
Heavy Atom Count | 19 |
---|
Formal Charge | 0 |
---|
Complexity | 300.000 |
---|
Isotope Atom Count | 0 |
---|
Defined Atom Stereocenter Count | 0 |
---|
Undefined Atom Stereocenter Count | 0 |
---|
Defined Bond Stereocenter Count | 0 |
---|
Undefined Bond Stereocenter Count | 0 |
---|
The total count of all stereochemical bonds | 0 |
---|
Covalently-Bonded Unit Count | 1 |
---|
Safety and Hazards(GHS)
Pictogram(s) | GHS07 |
Signal | Warning |
Hazard Statements | H315:Causes skin irritation H319:Causes serious eye irritation H302:Harmful if swallowed |
Precautionary Statements | P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P362:Take off contaminated clothing. P270:Do not eat, drink or smoke when using this product. P337+P313:IF eye irritation persists: Get medical advice/attention. P332+P313:IF SKIN irritation occurs: Get medical advice/attention. P330:Rinse mouth. P301+P312:IF SWALLOWED: call a POISON CENTER/doctor/... IF you feel unwell. |
---|
Solution Calculators
Molarity Calculator
Determine the necessary mass, volume, or concentration for preparing a solution.
Dilution Calculator
Determine the dilution needed to prepare a stock solution.
Reconstitution Calculator