(2S,3S)-2-acetamido-3-methylpentanamide

Base Information

• Chemical Name: (2S,3S)-2-acetamido-3-methylpentanamide
• CAS No.: 56711-06-9
• Molecular Formula: C8H16N2O2
• Molecular Weight: 172.22
• Hs Code.: 2924199090
• DSSTox Substance ID: DTXSID10426217
• Nikkaji Number: J2.060.935D
• Wikidata: Q82239177
• Mol file: 56711-06-9.mol

Synonyms:AC-ILE-NH2;56711-06-9;Acetyl-L-isoleucine amide;(2S,3S)-2-acetamido-3-methylpentanamide;Ac-L-Ile-NH2;acetyl-l-isoleucineamide;N~2~-Acetyl-L-isoleucinamide;SCHEMBL10137041;DTXSID10426217;MFCD00080832;AKOS006275706;FD21826;AS-49214;Pentanamide,2-(acetylamino)-3-methyl-,(2S,3S)-;2-[[(1-ETH-1-YNYLBUT-2-ENYL)OXY]CARBONYL]BENZOICACID

Chemical Property of (2S,3S)-2-acetamido-3-methylpentanamide

Chemical Property:

• Vapor Pressure: 2.16E-06mmHg at 25°C
• Refractive Index: 1.462
• Boiling Point: 393.2 °C at 760 mmHg
• Flash Point: 191.6 °C
• PSA: 72.19000
• Density: 1.024 g/cm³
• LogP: 1.11370
• Storage Temp.: Store at 0-5°C
• XLogP3: 0
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 172.121177757
• Heavy Atom Count: 12
• Complexity: 180

Purity/Quality:

98%Min ^*data from raw suppliers

Acetyl-L-isoleucine amide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C(C(=O)N)NC(=O)C
• Isomeric SMILES: CC[C@H](C)[C@@H](C(=O)N)NC(=O)C