596-50-9
POLDINE
Name
POLDINE
Formula
C21 H26 N O3
MolWeight
340.44
1Identification
【Name】
POLDINE
【CAS】
【MDL】
MFCD09837993
【English Synonyms】
【Formula】
C21 H26 N O3
【MolWeight】
340.44
【Inchi】
InChI=1S/C21H26NO3/c1-22(2)15-9-14-19(22)16-25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19,24H,9,14-16H2,1-2H3/q+1
【InChIKey】
InChIKey=CQRKVVAGMJJJSR-UHFFFAOYSA-N
【SMILES】
C[N+]1(CCCC1COC(=O)C(c2ccccc2)(c3ccccc3)O)C
【MOL File】
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
POLDINE.cml
Quick Release
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