54817-88-8
Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxy-3-nitro-, (R)-
NameBenzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxy-3-nitro-, (R)-
1Identification
【Name】
Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxy-3-nitro-, (R)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C13H16N2O7
【MolWeight】
312.2753
【Inchi】
InChI=1S/C13H16N2O7/c1-13(2,3)22-12(19)14-10(11(17)18)7-4-5-9(16)8(6-7)15(20)21/h4-6,10,16H,1-3H3,(H,14,19)(H,17,18)/t10-/m1/s1
【InChIKey】
InChIKey=LDMUNPMMUXHHFX-SNVBAGLBSA-N
【SMILES】
CC(C)(OC(=O)N[C@@H](C(=O)O)C1=CC(=C(C=C1)O)[N+](=O)[O-])C
【MOL File】
Benzeneacetic acid, ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
Benzeneacetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-4-hydroxy-3-nitro-, (R)-.cml