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4-[(3-hydroxy-5-methyl-4H-pyrazol-4-yl)[2-(prop-2-en-1-yloxy)phenyl]methyl]-5-methyl-4H-pyrazol-3-ol

4-[(3-hydroxy-5-methyl-4H-pyrazol-4-yl)[2-(prop-2-en-1-yloxy)phenyl]methyl]-5-methyl-4H-pyrazol-3-ol

Formula: C18H20N4O3

SMILES: CC1=NN=C(O)C1C(C1C(C)=NN=C1O)C1=CC=CC=C1OCC=C

IUPAC: 4-[(3-hydroxy-5-methyl-4H-pyrazol-4-yl)[2-(prop-2-en-1-yloxy)phenyl]methyl]-5-methyl-4H-pyrazol-3-ol

InChI: InChI=1/C18H20N4O3/c1-4-9-25-13-8-6-5-7-12(13)16(14-10(2)19-21-17(14)23)15-11(3)20-22-18(15)24/h4-8,14-16H,1,9H2,2-3H3,(H,21,23)(H,22,24)

Composition: C (63.52%), H (5.92%), N (16.46%), O (14.10%)

Molar Mass: 340.383

Atom Count: 45

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 340.15354052
Formal Charge 0
FSP3 0.33
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 2
InChIKey UFFFUWUIIVBNAL-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.7
Topological Polar Surface Area 99.13
Polarizability 35.21
Ring Count 3
Rotatable Bond Count 6

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H20N4O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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