67465-58-1
3-HYDROXYMETHYL-1-METHYLPYRIDINIUM BROMIDE DIMETHYLCARBAMATE
Name3-HYDROXYMETHYL-1-METHYLPYRIDINIUM BROMIDE DIMETHYLCARBAMATE
pro_formulaC10 H15 N2 O2 . Br
1Identification
【Name】
3-HYDROXYMETHYL-1-METHYLPYRIDINIUM BROMIDE DIMETHYLCARBAMATE
【CAS】
【MDL】
MFCD01691080
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C10 H15 N2 O2 . Br
【pro_molWeight】
275.145
【Inchi】
InChI=1S/C10H15N2O2.BrH/c1-11(2)10(13)14-8-9-5-4-6-12(3)7-9;/h4-7H,8H2,1-3H3;1H/q+1;/p-1
【InChIKey】
InChIKey=XLZIJYOONHGGRM-UHFFFAOYSA-M
【SMILES】
C[n+]1cccc(c1)COC(=O)N(C)C.[Br-]
【MOL File】
3-HYDROXYMETHYL-1-ME….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:-1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
3-HYDROXYMETHYL-1-METHYLPYRIDINIUM BROMIDE DIMETHYLCARBAMATE.cml