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Triaziflam

CAT: 1596-AR-T05848-04Size: 100 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-T05848-04Size:100 Units
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CAS Number
131475-57-5
Molecular Formula
C17H24FN5O
Molecular Weight
333.41
API Name
Triaziflam

Chemical Information

Triaziflam

N-[1-(3,5-dimethylphenoxy)propan-2-yl]-6-(2-fluoropropan-2-yl)-1,3,5-triazine-2,4-diamine is a diamino-1,3,5-triazine that is 1,3,5-triazine substituted by a [1-(3,5-dimethylphenoxy)propan-2-yl]nitrilo group, amino group and 2-fluoropropan-2-yl group at positions 2,4 and 6, respectively. It is an aromatic ether, an organofluorine compound, a diamino-1,3,5-triazine and a secondary amino compound.

CAS Number131475-57-5
PubChem CID10947588
IUPAC Name2-N-[1-(3,5-dimethylphenoxy)propan-2-yl]-6-(2-fluoropropan-2-yl)-1,3,5-triazine-2,4-diamine
Molecular FormulaC17H24FN5O
Molecular Weight333.4
XLogP3.5
Topological Polar Surface Area86
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity387
SMILES
CC1=CC(=CC(=C1)OCC(C)NC2=NC(=NC(=N2)N)C(C)(C)F)C
InChI
InChI=1S/C17H24FN5O/c1-10-6-11(2)8-13(7-10)24-9-12(3)20-16-22-14(17(4,5)18)21-15(19)23-16/h6-8,12H,9H2,1-5H3,(H3,19,20,21,22,23)
InChIKey
IUFUITYPUYMIHI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Triaziflam
CAS: 131475-57-5
CID: 10947588
Formula: C17H24FN5O
MW: 333.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight333.4
XLogP33.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass333.19648857
Monoisotopic Mass333.19648857
Topological Polar Surface Area86 Ų
Heavy Atom Count24
Formal Charge0
Complexity387
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
GW3625-25mgTriaziflam

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