N,N-Dimethyl-his-ome

Base Information

• Chemical Name: N,N-Dimethyl-his-ome
• CAS No.: 170227-64-2
• Molecular Formula: C9H15N3O2
• Molecular Weight: 197.23
• Hs Code.: 2933299090
• DSSTox Substance ID: DTXSID30426532
• Wikidata: Q82239423
• Mol file: 170227-64-2.mol

Synonyms:170227-64-2;N,N-DIMETHYL-HIS-OME;N,N-Dimethyl-histidine-OMe;N,N-Dimethyl-histidine methyl ester;methyl (2S)-2-(dimethylamino)-3-(1H-imidazol-5-yl)propanoate;SCHEMBL12199030;DTXSID30426532;N,N-Dimethyl-histidinemethylester;MFCD01318773;AKOS006279534;AKOS030241941;N,N-Dimethyl-L-histidine methyl ester;FD21709;AS-49170;L-Histidine,N,N-dimethyl-, methyl ester;CS-0333892

Chemical Property of N,N-Dimethyl-his-ome

Chemical Property:

• Boiling Point: 368.2 °C at 760 mmHg
• PKA: 14.13±0.10(Predicted)
• Flash Point: 176.5 °C
• PSA: 58.22000
• Density: 1.153 g/cm³
• LogP: 0.05540
• Storage Temp.: 2-8°C
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 197.116426730
• Heavy Atom Count: 14
• Complexity: 197

Purity/Quality:

98%Min ^*data from raw suppliers

N,N-Dimethyl-L-histidineMethylEster ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C(CC1=CN=CN1)C(=O)OC
• Isomeric SMILES: CN(C)[C@@H](CC1=CN=CN1)C(=O)OC
• Uses: N,N-Dimethyl-L-histidine Methyl Ester was used in the preparation of 2-mercaptoimidazole-4-alkanoates and analogs as antioxidants.