54676-00-5
1-ALLYL-2-METHYL-5-VINYL-PYRIDINIUM, BROMIDE
Name1-ALLYL-2-METHYL-5-VINYL-PYRIDINIUM, BROMIDE
1Identification
【Name】
1-ALLYL-2-METHYL-5-VINYL-PYRIDINIUM, BROMIDE
【CAS】
【MDL】
MFCD00184141
【English Synonyms】
【Formula】
C11 H14 N . Br
【MolWeight】
240.143
【Inchi】
InChI=1S/C11H14N.BrH/c1-4-8-12-9-11(5-2)7-6-10(12)3;/h4-7,9H,1-2,8H2,3H3;1H/q+1;/p-1
【InChIKey】
InChIKey=UMBQFFNAMXHYHA-UHFFFAOYSA-M
【SMILES】
Cc1ccc(c[n+]1CC=C)C=C.[Br-]
【MOL File】
1-ALLYL-2-METHYL-5-V….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-ALLYL-2-METHYL-5-VINYL-PYRIDINIUM, BROMIDE.cml