79078-31-2
2-(BROMOMETHYL)-4-NITROPYRIDIN-1-IUM-1-OLATE
Name
2-(BROMOMETHYL)-4-NITROPYRIDIN-1-IUM-1-OLATE
Formula
C6 H5 Br N2 O3
MolWeight
233.02
1Identification
【Name】
2-(BROMOMETHYL)-4-NITROPYRIDIN-1-IUM-1-OLATE
【CAS】
【MDL】
MFCD11036208
【English Synonyms】
【Formula】
C6 H5 Br N2 O3
【MolWeight】
233.02
【Inchi】
InChI=1S/C6H5BrN2O3/c7-4-6-3-5(9(11)12)1-2-8(6)10/h1-3H,4H2
【InChIKey】
InChIKey=DAAPWWCPWYUAEI-UHFFFAOYSA-N
【SMILES】
c1c[n+](c(cc1[N+](=O)[O-])CBr)[O-]
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(BROMOMETHYL)-4-NITROPYRIDIN-1-IUM-1-OLATE.cml
Quick Release
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