102338-95-4
4-BUTYLAMINOSALICYLIC ACID 3-PIPERIDINOPROPYL ESTER DIHYDROCHLORIDE
Name4-BUTYLAMINOSALICYLIC ACID 3-PIPERIDINOPROPYL ESTER DIHYDROCHLORIDE
FormulaC19 H30 N2 O3 . 2 Cl H
1Identification
【Name】
4-BUTYLAMINOSALICYLIC ACID 3-PIPERIDINOPROPYL ESTER DIHYDROCHLORIDE
【CAS】
【MDL】
MFCD01684490
【English Synonyms】
【Formula】
C19 H30 N2 O3 . 2 Cl H
【MolWeight】
407.379
【Inchi】
InChI=1S/C19H30N2O3.2ClH/c1-2-3-10-20-16-8-9-17(18(22)15-16)19(23)24-14-7-13-21-11-5-4-6-12-21;;/h8-9,15,20,22H,2-7,10-14H2,1H3;2*1H
【InChIKey】
InChIKey=KXSFVAURGRUWQE-UHFFFAOYSA-N
【SMILES】
CCCCNc1ccc(c(c1)O)C(=O)OCCCN2CCCCC2.Cl.Cl
【MOL File】
4-BUTYLAMINOSALICYLI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BUTYLAMINOSALICYLIC ACID 3-PIPERIDINOPROPYL ESTER DIHYDROCHLORIDE.cml