22900-11-4

Name N-ACETYLNEURAMINIC ACID METHYL ESTER
CAS 22900-11-4
Molecular Formula C12H21NO9
MDL Number MFCD08276447
Molecular Weight 323.3
MOL File 22900-11-4.mol
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Chemical Properties

Melting point  193.5-194.5°C
Boiling point  693.8±55.0 °C(Predicted)
density  1.51±0.1 g/cm3(Predicted)
refractive index  -27.5 ° (C=1, H2O)
storage temp.  Freezer
solubility  soluble in Methanol
Water Solubility  Slightly soluble in water
form  powder to crystal
pka 10.40±0.70(Predicted)
color  White to Almost white
InChI InChI=1/C12H21NO9/c1-5(15)13-8-6(16)3-12(20,11(19)21-2)22-10(8)9(18)7(17)4-14/h6-10,14,16-18,20H,3-4H2,1-2H3,(H,13,15)/t6-,7+,8+,9+,10+,12-/s3
InChIKey BKZQMWNJESHHSA-AGNBLMTLSA-N
SMILES [C@@H]([C@]1([H])O[C@](O)(C(=O)OC)C[C@H](O)[C@H]1NC(=O)C)(O)[C@H](O)CO |&1:0,1,4,11,13,19,r|
CAS DataBase Reference 22900-11-4

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P280-P301+P312-P302+P352-P305+P351+P338
HS Code  2940.00.6000

Hazard Information

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