N-Acetyl-2-(3-methoxyphenyl)neuraminic acid

Base Information

• Chemical Name: N-Acetyl-2-(3-methoxyphenyl)neuraminic acid
• CAS No.: 30804-44-5
• Molecular Formula: C18H25 N O10
• Molecular Weight: 415.3918
• European Community (EC) Number: 250-343-7
• Mol file: 30804-44-5.mol

Synonyms:EINECS 250-343-7;N-Acetyl-2-(3-methoxyphenyl)neuraminic acid;30804-44-5

Chemical Property of N-Acetyl-2-(3-methoxyphenyl)neuraminic acid

Chemical Property:

• Boiling Point: 803.3°Cat760mmHg
• Flash Point: 439.6°C
• PSA: 178.50000
• Density: 1.49g/cm³
• LogP: -0.93620
• Storage Temp.: −20°C
• XLogP3: -1.1
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 8
• Exact Mass: 415.14784599
• Heavy Atom Count: 29
• Complexity: 575

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)OC2=CC=CC(=C2)OC)O
• Isomeric SMILES: CC(=O)N[C@@H]1[C@H](C[C@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)O)OC2=CC=CC(=C2)OC)O