Products for Research Use Only

Paclobutrazol (Standard)

CAT: 0804-HY-B0853R-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-B0853R-01Size:50 mg
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Description
Paclobutrazol (Standard) is the analytical standard of Paclobutrazol. This product is intended for research and analytical applications. Paclobutrazol is a triazole-containing plant growth retardant that is known to inhibit the biosynthesis of gibberellins. Paclobutrazol also has antifungal activities. Paclobutrazol, transported acropetally in plants, can also suppress the synthesis of abscisic acid and induce chilling tolerance in plants. Paclobutrazol is typically used to support research on the role of gibberellins in plant biology[1][2].
CAS Number
76738-62-0
UNSPSC
12352005
Target
Fungal; Reference Standards
Type
Reference Standards
Related Pathways
Anti-infection; Others
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/paclobutrazol-standard.html
Purity
96.55
Smiles
O[C@@H](C(C)(C)C)[C@@H](N1N=CN=C1)CC2=CC=C(Cl)C=C2
Molecular Formula
C15H20ClN3O
Molecular Weight
293.79
Shipping Conditions
Blue Ice
Storage Conditions
4°C, sealed storage, away from light and moisture, under nitrogen
Scientific Category
Reference Standards

Chemical Information

Paclobutrazol

(S,S)-paclobutrazol is a 1-(4-chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol in which both stereocentres have S configuration. It is an enantiomer of a (R,R)-paclobutrazol.

CAS Number76738-62-0
PubChem CID73671
IUPAC Name(2S,3S)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol
Molecular FormulaC15H20ClN3O
Molecular Weight293.79
XLogP3.2
Topological Polar Surface Area50.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count20
Formal Charge0
Complexity300
SMILES
CC(C)(C)[C@@H]([C@H](CC1=CC=C(C=C1)Cl)N2C=NC=N2)O
InChI
InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3/t13-,14+/m0/s1
InChIKey
RMOGWMIKYWRTKW-UONOGXRCSA-N
Chemical Structure
2D Structure
2D structure of Paclobutrazol
CAS: 76738-62-0
CID: 73671
Formula: C15H20ClN3O
MW: 293.79
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight293.79
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass293.1294900
Monoisotopic Mass293.1294900
Topological Polar Surface Area50.9 Ų
Heavy Atom Count20
Formal Charge0
Complexity300
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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