2,6-bis[(4,6-Dimethoxy-2-pyrimidinyl)oxy]benzoic acid

2,6-bis[(4,6-Dimethoxy-2-pyrimidinyl)oxy]benzoic acid

Category:

CAS:

Description:
Bispyribac sodium belongs to the class of pyrimidinyl carboxy herbicides utilized for the post-emergence control of cyperaceous and dicotyledonous grasses and broad-leaf weeds.

CID 23682789
Synonyms sodium; 2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate; Bispyribac-sodium; 125401-92-5; Bispyribacsodium; Sodium2,6-bis((4,6-dimethoxypyrimidin-2-yl)oxy)benzoate
IUPAC Name sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate
Molecular Weight 452.350049
Molecular Formula C19H17N4NaO8
Canonical SMILES COC1=CC(=NC(=N1)OC2=C(C(=CC=C2)OC3=NC(=CC(=N3)OC)OC)C(=O)[O-])OC.[Na+]
InChI InChI=1S/C19H18N4O8.Na/c1-26-12-8-13(27-2)21-18(20-12)30-10-6-5-7-11(16(10)17(24)25)31-19-22-14(28-3)9-15(23-19)29-4;/h5-9H,1-4H3,(H,24,25);/q;+1/p-1
InChIKey FUHMZYWBSHTEDZ-UHFFFAOYSA-M
UNII 4NVB39F4NF

Producut details

Appearance White powder
Boiling Point 686.4°C at 760 mmHg
Melting Point 223-224°C
Shelf Life Limited shelf life, expiry date on the label

Chemical and Physical Properties

Purity 95%
Density 1.379 g/cm3
Storage 0-6°C
Complexity 515
Exact Mass 452.0944078
Heavy Atom Count 32
Hydrogen Bond Acceptor Count 12
Hydrogen Bond Donor Count 0
Monoisotopic Mass 452.0944078
Rotatable Bond Count 9
Topological Polar Surface Area 147

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