159107-42-3
BOC-THREO-BETA-METHYL-DL-ASPARTIC ACID
NameBOC-THREO-BETA-METHYL-DL-ASPARTIC ACID
1Identification
【Name】
BOC-THREO-BETA-METHYL-DL-ASPARTIC ACID
【CAS】
【MDL】
MFCD02682505
【English Synonyms】
【Formula】
C10 H17 N O6
【MolWeight】
247.245
【Inchi】
InChI=1S/C10H17NO6/c1-5(7(12)13)6(8(14)15)11-9(16)17-10(2,3)4/h5-6H,1-4H3,(H,11,16)(H,12,13)(H,14,15)/t5-,6-/m1/s1
【InChIKey】
InChIKey=HMBGLGONPRHXGP-PHDIDXHHSA-N
【SMILES】
C[C@H]([C@H](C(=O)O)NC(=O)OC(C)(C)C)C(=O)O
【MOL File】
BOC-THREO-BETA-METHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BOC-THREO-BETA-METHYL-DL-ASPARTIC ACID.cml