90729-41-2
OXODIPINE
Name
OXODIPINE
Formula
C19 H21 N O6
MolWeight
359.376
1Identification
【Name】
OXODIPINE
【CAS】
【MDL】
MFCD00867068
【English Synonyms】
【Formula】
C19 H21 N O6
【MolWeight】
359.376
【Inchi】
InChI=1S/C19H21NO6/c1-5-24-19(22)15-11(3)20-10(2)14(18(21)23-4)16(15)12-7-6-8-13-17(12)26-9-25-13/h6-8,16,20H,5,9H2,1-4H3
【InChIKey】
InChIKey=MSOAVHHAZCMHDI-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1=C(NC(=C(C1c2cccc3c2OCO3)C(=O)OC)C)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
OXODIPINE.cml
Quick Release
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http://www.youchemicals.com
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