19854-92-3 | MEthanone, phenyl-1H-pyrazol-3-yl-

Packsize	Purity	Availability	Price	Discounted Price
100mg	95%	in stock	$185.00	$129.00

Description

• Catalog Number: AB08128
• Chemical Name: MEthanone, phenyl-1H-pyrazol-3-yl-
• CAS Number: 19854-92-3
• Molecular Formula: C10H8N2O
• Molecular Weight: 172.1833
• MDL Number: MFCD08437287
• SMILES: O=C(c1n[nH]cc1)c1ccccc1

Computed Properties

• Complexity: 187
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 1.9

Literature

• Dichlorido(3,5-dimethyl-1H-pyrazole)[(3,5-dimethyl-1H-pyrazol-1-yl)(o-tol-yl)methanone]palladium(II).

  Acta crystallographica. Section E, Structure reports online 20080101

• Structural basis for herbicidal inhibitor selectivity revealed by comparison of crystal structures of plant and mammalian 4-hydroxyphenylpyruvate dioxygenases.

  Biochemistry 20040817