500770-81-0
BOC-(S)-3-AMINO-3-(3-CYANO-PHENYL)-PROPIONIC ACID
Name
BOC-(S)-3-AMINO-3-(3-CYANO-PHENYL)-PROPIONIC ACID
Formula
C15 H18 N2 O4
MolWeight
290.317
1Identification
【Name】
BOC-(S)-3-AMINO-3-(3-CYANO-PHENYL)-PROPIONIC ACID
【CAS】
【MDL】
MFCD03427929
【English Synonyms】
【Formula】
C15 H18 N2 O4
【MolWeight】
290.317
【Inchi】
InChI=1S/C15H18N2O4/c1-15(2,3)21-14(20)17-12(8-13(18)19)11-6-4-5-10(7-11)9-16/h4-7,12H,8H2,1-3H3,(H,17,20)(H,18,19)/t12-/m0/s1
【InChIKey】
InChIKey=QSPUAVCHVGCBGN-LBPRGKRZSA-N
【SMILES】
CC(C)(C)OC(=O)N[C@@H](CC(=O)O)c1cccc(c1)C#N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
Chem-Impex International, Inc. :BOC-(S)-3-AMINO-3-(3-CYANO-PHENYL)-PROPIONIC ACID
【WGK Germany】
3
4CML File
BOC-(S)-3-AMINO-3-(3-CYANO-PHENYL)-PROPIONIC ACID.cml
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