13246-02-1
FEBARBAMATE
Name
FEBARBAMATE
Formula
C20 H27 N3 O6
MolWeight
405.448
1Identification
【Name】
FEBARBAMATE
【CAS】
【MDL】
MFCD00868188
【English Synonyms】
【Formula】
C20 H27 N3 O6
【MolWeight】
405.448
【Inchi】
InChI=1S/C20H27N3O6/c1-3-5-11-28-13-15(29-18(21)26)12-23-17(25)20(4-2,16(24)22-19(23)27)14-9-7-6-8-10-14/h6-10,15H,3-5,11-13H2,1-2H3,(H2,21,26)(H,22,24,27)
【InChIKey】
InChIKey=QHZQILHUJDRDAI-UHFFFAOYSA-N
【SMILES】
CCCCOCC(CN1C(=O)C(C(=O)NC1=O)(CC)c2ccccc2)OC(=O)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:9
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
FEBARBAMATE.cml
Quick Release
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