500294-64-4
3-[4-(3-METHYLPHENYL)PIPERAZIN-1-YL]PROPANOIC ACID
Name3-[4-(3-METHYLPHENYL)PIPERAZIN-1-YL]PROPANOIC ACID
1Identification
【Name】
3-[4-(3-METHYLPHENYL)PIPERAZIN-1-YL]PROPANOIC ACID
【CAS】
【MDL】
MFCD06742328
【English Synonyms】
【Formula】
C14 H20 N2 O2
【MolWeight】
248.324
【Inchi】
InChI=1S/C14H20N2O2/c1-12-3-2-4-13(11-12)16-9-7-15(8-10-16)6-5-14(17)18/h2-4,11H,5-10H2,1H3,(H,17,18)
【InChIKey】
InChIKey=GDDMWIBZSURPKZ-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1)N2CCN(CC2)CCC(=O)O
【MOL File】
3-[4-(3-METHYLPHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-[4-(3-METHYLPHENYL)PIPERAZIN-1-YL]PROPANOIC ACID.cml