173154-02-4
2-FURANBUTANOIC ACID, GAMMA-AZIDOTETRAHYDRO-ALPHA,4-BIS(1-METHYLETHYL)-5-OXO-, (ALPHAS,GAMMAS,2S,4S)-
Name2-FURANBUTANOIC ACID, GAMMA-AZIDOTETRAHYDRO-ALPHA,4-BIS(1-METHYLETHYL)-5-OXO-, (ALPHAS,GAMMAS,2S,4S)-
1Identification
【Name】
2-FURANBUTANOIC ACID, GAMMA-AZIDOTETRAHYDRO-ALPHA,4-BIS(1-METHYLETHYL)-5-OXO-, (ALPHAS,GAMMAS,2S,4S)-
【CAS】
【MDL】
MFCD22380690
【English Synonyms】
【Formula】
C14 H23 N3 O4
【MolWeight】
297.353
【Inchi】
InChI=1S/C14H23N3O4/c1-7(2)9(13(18)19)5-11(16-17-15)12-6-10(8(3)4)14(20)21-12/h7-12H,5-6H2,1-4H3,(H,18,19)/t9-,10+,11+,12+/m1/s1
【InChIKey】
InChIKey=JRAKHRBLANMPFO-RHYQMDGZSA-N
【SMILES】
CC(C)[C@@H]1C[C@H](OC1=O)[C@H](C[C@H](C(C)C)C(=O)O)N=[N+]=[N-]
【MOL File】
2-FURANBUTANOIC ACID….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-FURANBUTANOIC ACID, GAMMA-AZIDOTETRAHYDRO-ALPHA,4-BIS(1-METHYLETHYL)-5-OXO-, (ALPHAS,GAMMAS,2S,4S)-.cml