51009-65-5
7-羟基-6,8-二氧杂-3,11-二氮杂-7-硼杂十三烷-1,13-二醇
Name
7-羟基-6,8-二氧杂-3,11-二氮杂-7-硼杂十三烷-1,13-二醇
pro_formula
C14 H17 N3 O S
pro_molWeight
275.374
1Identification
【Name】
7-羟基-6,8-二氧杂-3,11-二氮杂-7-硼杂十三烷-1,13-二醇
【CAS】
【MDL】
MFCD00479456
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C14 H17 N3 O S
【pro_molWeight】
275.374
【Inchi】
InChI=1S/C14H17N3OS/c1-3-17(4-2)11-7-5-10(6-8-11)9-12-13(18)16-14(19)15-12/h5-9H,3-4H2,1-2H3,(H2,15,16,18,19)/b12-9+
【InChIKey】
InChIKey=RHTNYOJDJNSDCD-FMIVXFBMSA-N
【SMILES】
CCN(CC)c1ccc(cc1)/C=C/2\C(=O)NC(=S)N2
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:4
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
7-羟基-6,8-二氧杂-3,11-二氮杂-7-硼杂十三烷-1,13-二醇.cml
quick_release
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