863752-90-3
1-METHYL-5-(2-METHYL-1-PROPEN-1-YL)-1H-PYRAZOLE-3-CARBOXYLIC ACID
Name
1-METHYL-5-(2-METHYL-1-PROPEN-1-YL)-1H-PYRAZOLE-3-CARBOXYLIC ACID
Formula
C9 H12 N2 O2
MolWeight
180.206
1Identification
【Name】
1-METHYL-5-(2-METHYL-1-PROPEN-1-YL)-1H-PYRAZOLE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD16619976
【English Synonyms】
【Formula】
C9 H12 N2 O2
【MolWeight】
180.206
【Inchi】
InChI=1S/C9H12N2O2/c1-6(2)4-7-5-8(9(12)13)10-11(7)3/h4-5H,1-3H3,(H,12,13)
【InChIKey】
InChIKey=SXCZTYCRUCMBHF-UHFFFAOYSA-N
【SMILES】
CC(=Cc1cc(nn1C)C(=O)O)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-METHYL-5-(2-METHYL-1-PROPEN-1-YL)-1H-PYRAZOLE-3-CARBOXYLIC ACID.cml
Quick Release
1-(1,1-DIMETHYLETHYL)-5-METHYL-1H-PYRAZOL-3-AMINE
880488-27-7
1-ACETYL-3(5)-TRIFLUOROMETHYL-5(3)-(METHYL)PYRAZOLE
959573-03-6
1,5-DIMETHYL-1H-PYRAZOLE-3-CARBOXAMIDE
54384-74-6
1,5-DIMETHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
5744-59-2
1,5-DIMETHYL-1H-PYRAZOLE-3-CARBALDEHYDE
25016-10-8
1,5-DIMETHYL-1H-PYRAZOL-3-YLAMINE
35100-92-6
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