Hexanoic acid, 3-(aminomethyl)-4,5-dimethyl-, (3R,4R)-

Base Information

• Chemical Name: Hexanoic acid, 3-(aminomethyl)-4,5-dimethyl-, (3R,4R)-
• CAS No.: 313651-25-1
• Molecular Formula: C9H19NO2
• Molecular Weight: 173.25300
• Wikidata: Q4637181
• ChEMBL ID: CHEMBL190602
• Mol file: 313651-25-1.mol

Synonyms:Hexanoic acid, 3-(aminomethyl)-4,5-dimethyl-, (3R,4R)-;CHEMBL190602;SCHEMBL1914043;AKOS006291583;Q4637181

Chemical Property of Hexanoic acid, 3-(aminomethyl)-4,5-dimethyl-, (3R,4R)-

Chemical Property:

• PSA: 63.32000
• LogP: 2.02840
• XLogP3: -1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 173.141578849
• Heavy Atom Count: 12
• Complexity: 146

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C)C(CC(=O)O)CN
• Isomeric SMILES: C[C@@H]([C@@H](CC(=O)O)CN)C(C)C