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Dodine

CAT: 0931-T25347-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T25347-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2439-10-3
Target
Others, Antibacterial
Related Pathways
Microbiology/Virology, Others
Bioactivity
Dodine is a fungicide used to control scab on apples, pears, and pecans, brown rot of peaches, and several foliar diseases of peaches, strawberries, cherries, sycamore trees, and black walnuts. It is also used as an industrial biocide and preservative.
Smiles
CC(O)=O.CCCCCCCCCCCCNC(N)=N
Molecular Formula
C15H33N3O2
Molecular Weight
287.44
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Dodine

1-dodecylguanidine acetate is an acetate salt resulting from the reaction of equimolar amounts of 1-dodecylguanidine and acetic acid. It is used as a fungicide to control black spot and foliar diseases on apples, pears, peaches, nectarines and strawberries. It has a role as an antibacterial agent and an antifungal agrochemical. It is an acetate salt and an aliphatic nitrogen antifungal agent. It contains a 1-dodecylguanidine(1+).

CAS Number2439-10-3
PubChem CID17110
IUPAC Nameacetic acid;2-dodecylguanidine
Molecular FormulaC15H33N3O2
Molecular Weight287.44
Topological Polar Surface Area102
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count11
Heavy Atom Count20
Formal Charge0
Complexity194
SMILES
CCCCCCCCCCCCN=C(N)N.CC(=O)O
InChI
InChI=1S/C13H29N3.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;1-2(3)4/h2-12H2,1H3,(H4,14,15,16);1H3,(H,3,4)
InChIKey
YIKWKLYQRFRGPM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dodine
CAS: 2439-10-3
CID: 17110
Formula: C15H33N3O2
MW: 287.44
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight287.44
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count11
Exact Mass287.25727730
Monoisotopic Mass287.25727730
Topological Polar Surface Area102 Ų
Heavy Atom Count20
Formal Charge0
Complexity194
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes