71693-36-2
3,4-DINITROPHENYL N-ACETYL-BETA-D-GLUCOSAMINIDE
Name3,4-DINITROPHENYL N-ACETYL-BETA-D-GLUCOSAMINIDE
1Identification
【Name】
3,4-DINITROPHENYL N-ACETYL-BETA-D-GLUCOSAMINIDE
【CAS】
【MDL】
MFCD00083308
【English Synonyms】
【Formula】
C14 H17 N3 O10
【MolWeight】
387.299
【Inchi】
InChI=1S/C14H17N3O10/c1-6(19)15-11-13(21)12(20)10(5-18)27-14(11)26-7-2-3-8(16(22)23)9(4-7)17(24)25/h2-4,10-14,18,20-21H,5H2,1H3,(H,15,19)/t10-,11-,12-,13-,14+/m1/s1
【InChIKey】
InChIKey=VNRVFJBSTVDYLL-KSTCHIGDSA-N
【SMILES】
CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1Oc2ccc(c(c2)[N+](=O)[O-])[N+](=O)[O-])CO)O)O
【MOL File】
3,4-DINITROPHENYL N-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:13
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,4-DINITROPHENYL N-ACETYL-BETA-D-GLUCOSAMINIDE.cml