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Amicarbazone 25mg

CAT: 0628-A21294-25Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0628-A21294-25Size:25 mg
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CAS Number
129909-90-6

Chemical Information

Amicarbazone

Amicarbazone is a member of the class of triazoles that is 4,5-dihydro-1H-1,2,4-triazol-5-one which is substituted at position 1 by a tert-butylaminocarbonyl group and at position 3 by an isopropyl group. A selective herbicide for pre- and post-emergence control of annual dicotyledonous weeds and grasses, it is not approved for use within the European Union. It has a role as a herbicide. It is a carbohydrazide and a member of triazoles.

CAS Number129909-90-6
PubChem CID153920
IUPAC Name4-amino-N-tert-butyl-5-oxo-3-propan-2-yl-1,2,4-triazole-1-carboxamide
Molecular FormulaC10H19N5O2
Molecular Weight241.29
XLogP1
Topological Polar Surface Area91
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity369
SMILES
CC(C)C1=NN(C(=O)N1N)C(=O)NC(C)(C)C
InChI
InChI=1S/C10H19N5O2/c1-6(2)7-13-15(9(17)14(7)11)8(16)12-10(3,4)5/h6H,11H2,1-5H3,(H,12,16)
InChIKey
ORFPWVRKFLOQHK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Amicarbazone
CAS: 129909-90-6
CID: 153920
Formula: C10H19N5O2
MW: 241.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight241.29
XLogP31
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass241.15387487
Monoisotopic Mass241.15387487
Topological Polar Surface Area91 Ų
Heavy Atom Count17
Formal Charge0
Complexity369
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

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