20788-07-2
RESORANTEL
Name
RESORANTEL
Formula
C13 H10 Br N O3
MolWeight
308.13
1Identification
【Name】
RESORANTEL
【CAS】
【MDL】
MFCD00864511
【English Synonyms】
【Formula】
C13 H10 Br N O3
【MolWeight】
308.13
【Inchi】
InChI=1S/C13H10BrNO3/c14-8-4-6-9(7-5-8)15-13(18)12-10(16)2-1-3-11(12)17/h1-7,16-17H,(H,15,18)
【InChIKey】
InChIKey=IHYNKGRWCDKNEG-UHFFFAOYSA-N
【SMILES】
c1cc(c(c(c1)O)C(=O)Nc2ccc(cc2)Br)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
RESORANTEL.cml
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