51421-04-6
3-AMINO-1-(2,5-DIMETHYLBENZYL)-1H-PYRAZOL-5(4H)-ONE
Name
3-AMINO-1-(2,5-DIMETHYLBENZYL)-1H-PYRAZOL-5(4H)-ONE
Formula
C12 H15 N3 O
MolWeight
217.27
1Identification
【Name】
3-AMINO-1-(2,5-DIMETHYLBENZYL)-1H-PYRAZOL-5(4H)-ONE
【CAS】
【MDL】
MFCD20226357
【English Synonyms】
【Formula】
C12 H15 N3 O
【MolWeight】
217.27
【Inchi】
InChI=1S/C12H15N3O/c1-8-3-4-9(2)10(5-8)7-15-12(16)6-11(13)14-15/h3-5H,6-7H2,1-2H3,(H2,13,14)
【InChIKey】
InChIKey=BBYWSZALQLDFCY-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1)CN2C(=O)CC(=N2)N)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-AMINO-1-(2,5-DIMETHYLBENZYL)-1H-PYRAZOL-5(4H)-ONE.cml
Quick Release
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Aroma Circle Corp.
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Catalog No:AC13676 5G
Catalog No:AC13676 1G
Country/Region:United States
Business Type:Others
http://www.aromacircle.com
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