methyl (1R,2R,4R)-bicyclo[2.2.1]hept-5-ene-2-carboxylate

Base Information

• Chemical Name: methyl (1R,2R,4R)-bicyclo[2.2.1]hept-5-ene-2-carboxylate
• CAS No.: 72203-34-0
• Molecular Formula: C9H12 O2
• Molecular Weight: 152.193
• DSSTox Substance ID: DTXSID70449528
• Nikkaji Number: J445.628I
• Mol file: 72203-34-0.mol

Synonyms:72203-34-0;DTXSID70449528;AG-G-83926;(1R,4R)-Norborna-2-ene-5alpha-carboxylic acid methyl ester

Chemical Property of methyl (1R,2R,4R)-bicyclo[2.2.1]hept-5-ene-2-carboxylate

Chemical Property:

• PSA: 26.30000
• LogP: 1.37160
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 152.083729621
• Heavy Atom Count: 11
• Complexity: 208

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1CC2CC1C=C2
• Isomeric SMILES: COC(=O)[C@@H]1C[C@H]2C[C@@H]1C=C2

Refernces

• 1、 Eda, Masahiro,Takemoto, Tadahiro,Ono, Shin-ichiro,Okada, Takehiro,Kosaka, Keigo,et al.. "Novel Potassium-Channel Openers: Preparation and Pharmacological Evaluation of Racemic and Optically Active N-(6-Amino-3-pyridyl)-N'-bicycloalkyl-N"-cyanoguanidine Derivatives". . p. 1983 - 1990. Retrieved 2007/10/02.
• 2、 Horton, Derek,Usui, Takayuki. "Transformations of unsaturated acyclic sugars into enantiomerically pure norbornene derivatives". . p. 33 - 49. Retrieved 2007/10/02.