851180-76-2
[1-(4-ISOPROPYLPHENYL)-5-METHYL-1H-PYRAZOL-4-YL]METHANOL
Name[1-(4-ISOPROPYLPHENYL)-5-METHYL-1H-PYRAZOL-4-YL]METHANOL
1Identification
【Name】
[1-(4-ISOPROPYLPHENYL)-5-METHYL-1H-PYRAZOL-4-YL]METHANOL
【CAS】
【MDL】
MFCD16657498
【English Synonyms】
【Formula】
C14 H18 N2 O
【MolWeight】
230.309
【Inchi】
InChI=1S/C14H18N2O/c1-10(2)12-4-6-14(7-5-12)16-11(3)13(9-17)8-15-16/h4-8,10,17H,9H2,1-3H3
【InChIKey】
InChIKey=RGCASNDFJRBUMG-UHFFFAOYSA-N
【SMILES】
Cc1c(cnn1c2ccc(cc2)C(C)C)CO
【MOL File】
[1-(4-ISOPROPYLPHENY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[1-(4-ISOPROPYLPHENYL)-5-METHYL-1H-PYRAZOL-4-YL]METHANOL.cml