2908-75-0
ESCULAMINE
Name
ESCULAMINE
Formula
C15 H19 N O6
MolWeight
309.316
1Identification
【Name】
ESCULAMINE
【CAS】
【MDL】
MFCD00731035
【English Synonyms】
【Formula】
C15 H19 N O6
【MolWeight】
309.316
【Inchi】
InChI=1S/C15H19NO6/c1-9-6-13(20)22-15-10(9)7-12(19)14(21)11(15)8-16(2-4-17)3-5-18/h6-7,17-19,21H,2-5,8H2,1H3
【InChIKey】
InChIKey=VQSXXDXNONIOGW-UHFFFAOYSA-N
【SMILES】
Cc1cc(=O)oc2c1cc(c(c2CN(CCO)CCO)O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ESCULAMINE.cml
Quick Release
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