218967-85-2
2-(5-HYDROXY-3-METHYL-1H-PYRAZOL-1-YL)ACETYL CYANIDE
Name
2-(5-HYDROXY-3-METHYL-1H-PYRAZOL-1-YL)ACETYL CYANIDE
Formula
C7 H7 N3 O2
MolWeight
165.151
1Identification
【Name】
2-(5-HYDROXY-3-METHYL-1H-PYRAZOL-1-YL)ACETYL CYANIDE
【CAS】
【MDL】
MFCD16620692
【English Synonyms】
【Formula】
C7 H7 N3 O2
【MolWeight】
165.151
【Inchi】
InChI=1S/C7H7N3O2/c1-5-2-7(12)10(9-5)4-6(11)3-8/h2,12H,4H2,1H3
【InChIKey】
InChIKey=PJBBVBDIZIUKBZ-UHFFFAOYSA-N
【SMILES】
Cc1cc(n(n1)CC(=O)C#N)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(5-HYDROXY-3-METHYL-1H-PYRAZOL-1-YL)ACETYL CYANIDE.cml
Quick Release
1-ALLYL-3,5-DIMETHYLPYRAZOLE
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1,3-DIMETHYL-1H-PYRAZOLE-5-ACETIC ACID
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