896047-00-0
1-(1,3-BENZODIOXOL-5-YLMETHYL)-3-PIPERIDINECARBOXYLIC ACID
Name
1-(1,3-BENZODIOXOL-5-YLMETHYL)-3-PIPERIDINECARBOXYLIC ACID
Formula
C14 H17 N O4
MolWeight
263.291
1Identification
【Name】
1-(1,3-BENZODIOXOL-5-YLMETHYL)-3-PIPERIDINECARBOXYLIC ACID
【CAS】
【MDL】
MFCD05170993
【English Synonyms】
【Formula】
C14 H17 N O4
【MolWeight】
263.291
【Inchi】
InChI=1S/C14H17NO4/c16-14(17)11-2-1-5-15(8-11)7-10-3-4-12-13(6-10)19-9-18-12/h3-4,6,11H,1-2,5,7-9H2,(H,16,17)
【InChIKey】
InChIKey=JUCIQKKLPSTGPR-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1CN3CCCC(C3)C(=O)O)OCO2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(1,3-BENZODIOXOL-5-YLMETHYL)-3-PIPERIDINECARBOXYLIC ACID.cml
Quick Release
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