2-(Acetylamino)-1,2-dideoxy-1-nitro-D-mannitol

Base Information

• Chemical Name: 2-(Acetylamino)-1,2-dideoxy-1-nitro-D-mannitol
• CAS No.: 14199-86-1
• Molecular Formula: C₈H₁₆N₂O₇
• Molecular Weight: 252.224
• DSSTox Substance ID: DTXSID801249893
• Nikkaji Number: J961.440K
• Mol file: 14199-86-1.mol

Synonyms:DTXSID801249893;14199-86-1;2-(Acetylamino)-1,2-dideoxy-1-nitro-D-mannitol

Chemical Property of 2-(Acetylamino)-1,2-dideoxy-1-nitro-D-mannitol

Chemical Property:

• XLogP3: -3.1
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 252.09575085
• Heavy Atom Count: 17
• Complexity: 267

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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