(2S)-4-(acetylamino)-2-aminobutanoic acid

Base Information

• Chemical Name: (2S)-4-(acetylamino)-2-aminobutanoic acid
• CAS No.: 1190-46-1
• Molecular Formula: C6H12N2O3
• Molecular Weight: 160.173
• Hs Code.: 2924199090
• DSSTox Substance ID: DTXSID30331556
• Nikkaji Number: J80.071F
• Wikidata: Q27107481
• Metabolomics Workbench ID: 53313
• Mol file: 1190-46-1.mol

Synonyms:1190-46-1;(2S)-4-acetamido-2-aminobutanoic acid;(2S)-4-(acetylamino)-2-aminobutanoic acid;N(4)-acetyl-L-2,4-diaminobutyric acid;N-gamma-Acetyldiaminobutyrate;N-Acetyl-L-2,4-diaminobutyrate;N-acetyl-L-2,4-diaminobutanoate;4-N-Acetyl-2,4-diaminobutyric acid;(S)-4-Acetamido-2-aminobutanoic acid;(2~{S})-4-acetamido-2-azanyl-butanoic acid;N4-Acetyl-L-2,4-diaminobutanoate;(2S)-4-acetamido-2-aminobutanoate;N4-Acetyl-L-2,4-diaminobutyrate;9YT;N-g-Acetyldiaminobutyric acid;N(gamma)-Acetyldiaminobutyrate;CHEBI:7351;SCHEMBL1768835;DTXSID30331556;Ngamma-Acetyl-L-diaminobutyric acid;MFCD21363201;(S)-4-Acetamido-2-aminobutanoicacid;AKOS030212919;(2S)-2-amino-4-acetamidobutanoic acid;C06442;Q27107481

Chemical Property of (2S)-4-(acetylamino)-2-aminobutanoic acid

Chemical Property:

• Boiling Point: 438.5±40.0 °C(Predicted)
• PKA: 2.24±0.10(Predicted)
• PSA: 95.91000
• Density: 1.211±0.06 g/cm3(Predicted)
• LogP: 0.46510
• XLogP3: -4.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 160.08479225
• Heavy Atom Count: 11
• Complexity: 158

Purity/Quality:

98%,99%, ^*data from raw suppliers

H-L-Dab(Ac)-OH ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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