CAS No.199119-58-9,Trifloxysulfuron-sodium Suppliers

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Basic Information

Molecular Structure:
CAS No.:	199119-58-9
Name:	Trifloxysulfuron-sodium

Formula:	C₁₄H₁₃F₃N₅NaO₆S
Molecular Weight:	459.33
Synonyms:	2-Pyridinesulfonamide,N-[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]-3-(2,2,2-trifluoroethoxy)-,monosodium salt (9CI);CGA 362622;Envoke;Monument;NOJ 120;Trifloxysulfuronsodium salt;Trifloxysulfuron-sodium;
EINECS:	200-528-9
Density:	0.002g/cm3 at 21℃
Melting Point:	175-177°C
Solubility:	Solubility in water (g/l at 25 °C) 0.063 (pH 5) 5.016 (pH 7) 25.7 (pH 7.4)
PSA:	141.22000
LogP:	2.67080

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Specification

The CAS register number of Trifloxysulfuron-sodium is 199119-58-9. It also can be called as Sodium N'-(4,6-dimethoxypyrimidin-2-yl)-N-[3-(2,2,2-trifluoroethoxy)-2-pyridylsulfonyl]imidocarbamate and the IUPAC name about this chemical is sodium N-(4,6-dimethoxypyrimidin-2-yl)-N'-[3-(2,2,2-trifluoroethoxy)pyridin-2-yl]sulfonylcarbamimidate. The molecular formula about this chemical is C₁₄H₁₃F₃N₅NaO₆S and molecular weight is 459.33. It belongs to the following product categories which include Q-ZPesticides & Metabolites; Urea structure; Alpha sort; Herbicides; Pesticides & Metabolites and so on.

Physical properties about Trifloxysulfuron-sodium are: (1)#H bond acceptors: 11; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 7; (4)Polar Surface Area: 141.22Å²; (5)H-Bond Donor: 1; (6)H-Bond Acceptor: 14; (7)Rotatable Bond Count: 8; (8)Tautomer Count: 3; (9)Exact Mass: 459.043633; (10)MonoIsotopic Mass: 459.043633; (11)Topological Polar Surface Area: 156; (12)Heavy Atom Count: 30; (13)Complexity: 653; (14)Undefined Bond StereoCenter Count: 1; (15)Covalently-Bonded Unit Count: 2.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1cc(nc(n1)NC(=O)N([Na])S(=O)(=O)c2c(cccn2)OCC(F)(F)F)OC
(2)InChI: InChI=1/C14H14F3N5O6S.Na/c1-26-9-6-10(27-2)20-12(19-9)21-13(23)22-29(24,25)11-8(4-3-5-18-11)28-7-14(15,16)17;/h3-6H,7H2,1-2H3,(H2,19,20,21,22,23);/q;+1/p-1/rC14H13F3N5NaO6S/c1-27-9-6-10(28-2)20-12(19-9)21-13(24)22(23)30(25,26)11-8(4-3-5-18-11)29-7-14(15,16)17/h3-6H,7H2,1-2H3,(H,19,20,21,24)
(3)InChIKey: UFEIWEXHHOXPGP-OIIDONJAAD
(4)Std. InChI: InChI=1S/C14H14F3N5O6S.Na/c1-26-9-6-10(27-2)20-12(19-9)21-13(23)22-29(24,25)11-8(4-3-5-18-11)28-7-14(15,16)17;/h3-6H,7H2,1-2H3,(H2,19,20,21,22,23);/q;+1/p-1
(5)Std. InChIKey: UFEIWEXHHOXPGP-UHFFFAOYSA-M