952511-32-9
3-甲基-5-亚肉桂花基<
Name
3-甲基-5-亚肉桂花基<
pro_formula
C8 H8 N4 O
pro_molWeight
176.178
1Identification
【Name】
3-甲基-5-亚肉桂花基<
【CAS】
【MDL】
MFCD18807957
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C8 H8 N4 O
【pro_molWeight】
176.178
【Inchi】
InChI=1S/C8H8N4O/c9-8(12-13)5-2-1-3-6-7(5)11-4-10-6/h1-4,13H,(H2,9,12)(H,10,11)
【InChIKey】
InChIKey=AQKFVBUKJPOODL-UHFFFAOYSA-N
【SMILES】
c1cc(c2c(c1)nc[nH]2)C(=N)NO
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:4
pro_acceptors:5
XLogP3:-3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
3-甲基-5-亚肉桂花基<.cml
quick_release
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