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Bupirimate

CAT: 1410-M27371-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M27371-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Bupirimate, an active ingredient in plant protection products, is commonly used as a systemic fungicide and finds applications in controlling powdery mildew in roses, apple plantations. It belongs to the family of pyrimidines.
CAS Number
41483-43-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
316.42
Molecular Formula
C13H24N4O3S
Notes
Research use only, not for human use.
Receptor
Oxidation-reduction

Chemical Information

Bupirimate

Bupirimate is a member of the class of aminopyrimidines that is 2-ethylaminopyrimidine carrying methyl, butyl and dimethylaminosulfooxy substituents at posiitons 4, 5 and 6 respectively. It has a role as an androgen antagonist and an antifungal agrochemical. It is an aminopyrimidine, a sulfamate ester, a secondary amino compound and a pyrimidine fungicide.

CAS Number41483-43-6
PubChem CID38884
IUPAC Name[5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl] N,N-dimethylsulfamate
Molecular FormulaC13H24N4O3S
Molecular Weight316.42
XLogP2.7
Topological Polar Surface Area92.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count21
Formal Charge0
Complexity397
SMILES
CCCCC1=C(N=C(N=C1OS(=O)(=O)N(C)C)NCC)C
InChI
InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)
InChIKey
DSKJPMWIHSOYEA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bupirimate
CAS: 41483-43-6
CID: 38884
Formula: C13H24N4O3S
MW: 316.42
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight316.42
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass316.15691181
Monoisotopic Mass316.15691181
Topological Polar Surface Area92.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity397
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes