8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 8-methyl-3-(4-(trimethylstannyl)phenyl)-, methyl ester, (1R,2S,3S,5S)-

Base Information

• Chemical Name: 8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 8-methyl-3-(4-(trimethylstannyl)phenyl)-, methyl ester, (1R,2S,3S,5S)-
• CAS No.: 158111-10-5
• Molecular Formula: C19H29 N O2 Sn
• Molecular Weight: 422.15
• UNII: K6PCO2A7B9
• Mol file: 158111-10-5.mol

Synonyms:Tms-ct;158111-10-5;K6PCO2A7B9;UNII-K6PCO2A7B9;8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 8-methyl-3-(4-(trimethylstannyl)phenyl)-, methyl ester, (1R,2S,3S,5S)-;methyl (1R,2S,3S,5S)-8-methyl-3-(4-trimethylstannylphenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate;8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 8-methyl-3-(4-(trimethylstannyl)phenyl)-, methyl ester, (1R-(exo,exo))-;8-AZABICYCLO[3.2.1]OCTANE-2-CARBOXYLIC ACID, 8-METHYL-3-[4-(TRIMETHYL-STANNYL)PHENYL]-, METHYL ESTER;SCHEMBL2815281;2beta-carbomethoxy-3beta-(4-trimethylstannylphenyl)tropane;8-Azabicyclo[3.2.1]octane-2-carboxylic acid,8-methyl-3-[4-(trimethyl-stannyl)phenyl]-,methyl ester,[1r-(exo,exo)]-

Chemical Property of 8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 8-methyl-3-(4-(trimethylstannyl)phenyl)-, methyl ester, (1R,2S,3S,5S)-

Chemical Property:

• Boiling Point: 417.3±55.0 °C(Predicted)
• PKA: 9.95±0.60(Predicted)
• PSA: 29.54000
• LogP: 2.90900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 423.122032
• Heavy Atom Count: 23
• Complexity: 439

Purity/Quality:

[1R-(EXO, EXO)]-8-METHYL-3-[4-(TRIMETHYL-STANNYL)PHENYL]-8-AZABICYCLO[3.2.1]OCTANE-2-CARBOXYLIC ACID METHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2CCC1C(C(C2)C3=CC=C(C=C3)[Sn](C)(C)C)C(=O)OC
• Isomeric SMILES: CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)C3=CC=C(C=C3)[Sn](C)(C)C)C(=O)OC