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725699-04-7
5-(4-ISOPROPYLPHENYL)-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID
Name
5-(4-ISOPROPYLPHENYL)-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID
Formula
C17 H14 F3 N3 O2
MolWeight
349.311
1Identification
【Name】
5-(4-ISOPROPYLPHENYL)-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD04967188
【English Synonyms】
【Formula】
C17 H14 F3 N3 O2
【MolWeight】
349.311
【Inchi】
InChI=1S/C17H14F3N3O2/c1-9(2)10-3-5-11(6-4-10)13-7-14(17(18,19)20)23-15(22-13)12(8-21-23)16(24)25/h3-9H,1-2H3,(H,24,25)
【InChIKey】
InChIKey=YATGANCZYPICPO-UHFFFAOYSA-N
【SMILES】
CC(C)c1ccc(cc1)c2cc(n3c(n2)c(cn3)C(=O)O)C(F)(F)F
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-(4-ISOPROPYLPHENYL)-7-(TRIFLUOROMETHYL)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID.cml
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Country/Region:China
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