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· · COA & SDS available for every product · Same-day shipping on in-stock items Isoproturon solution - analytical standard, ≥99% , CAS No.34123-59-6
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. ≥99% Synonyms
CL 12150|Isoproturon [ISO]|IP-Flo|Urea, 1,1-dimethyl-3-(p-isopropylphenyl)-|Iprofile|Graminon|HOE 16410|N'-(4-Isopropylphenyl)-N,N-dimethylurea|N-(4-Isopropylphenyl)-N',N'-dimethylurea|Tolkan|35689 R.P.|ISOPROTURON|Nocilon|3-(4-isopropylphenyl)-1,1-dimethyl-urea;Isoproturon|IPU Stefes|Protugan|Zodiac TX|1,1-dimethyl-3-[4-(propan-2-yl)phenyl]urea|N-(Isopropyl-4-phenyl)-N',N'-dimethyluree [French]|1,1-dimethyl-3-(p-isopropylphenyl)-urea|3-(4-Isopropylphenyl)-1,1-dimethylurea|3-(4-isopropylphenyl)-1,1-dimethyl-urea|N-4-Isopropylphenyl-N,N-dimethylurea|Urea, 3-p-cumenyl-1,1-dimethyl-|N,N-Dimethyl-N'-[4-(1-methylethyl)phenyl]urea|4-isopropylphenyl-N',N'-dimethylurea|ISOPROTURON [MI]|IP 50|Arelon|Urea, N,N-dimethyl-N'-(4-(1-methylethyl)phenyl)-|N,N-Dimethyl-N'-(4-(1-methylethyl)phenyl)urea|N,N-Dimethyl-N'-[4-(1-methylethyl)phenyl]Urea labeled with deuterium|IP50|N-(4-Isopropylphenyl)-N',N'-dimethylharnstoff|N-(Isopropyl-4-phenyl)-N',N'-dimethyluree|Belgran|CGA-18731|DPX 6774|N-(4-Isopropylphenyl)-N',N'-dimethylharnstoff [German]|Urea, N,N-dimethyl-N'-[4-(1-methylethyl)phenyl]-|3-p-Cumenyl-1,1-dimethylurea|1,1-dimethyl-3-(4-propan-2-ylphenyl)urea|Tolken|Alon
Specifications Synonyms
CL 12150 | Isoproturon [ISO] | IP-Flo | Urea, 1,1-dimethyl-3-(p-isopropylphenyl)- | Iprofile | Graminon | HOE 16410 | N'-(4-Isopropylphenyl)-N,N-dimethylurea | N-(4-Isopropylphenyl)-N',N'-dimethylurea | Tolkan | 35689 R.P. | ISOPROTURON | Nocilon | 3-(4-isopropylphenyl)-1,1-dimethyl-urea;Isoproturon | IPU Stefes | Protugan | Zodiac TX | 1 Show more
Specifications & Purity
analytical standard, ≥99%
Names and Identifiers Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504753555
Canonical Smiles
CC(C)C1=CC=C(C=C1)NC(=O)N(C)C
IUPAC Name
1,1-dimethyl-3-(4-propan-2-ylphenyl)urea
InChIKey
PUIYMUZLKQOUOZ-UHFFFAOYSA-N
INCHI
1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)
Isomeric SMILES
CC(C)C1=CC=C(C=C1)NC(=O)N(C)C
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2214033&ln=
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Benzenoids Class Benzene and substituted derivatives Subclass N-phenylureas Intermediate Tree Nodes Not available Direct Parent N-phenylureas Alternative Parents Phenylpropanes Cumenes Ureas Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents N-phenylurea - Phenylpropane - Cumene - Urea - Carbonic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group. External Descriptors Phenylurea herbicides Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(non-human) Mechanisms of Action Certificates (CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Flash Point(°F) 100 °C Flash Point(°C) 100°C Melt Point(°C) 155-156°C Molecular Weight 206.280 g/mol XLogP3 2.900 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 2 Exact Mass 206.142 Da Monoisotopic Mass 206.142 Da Topological Polar Surface Area 32.299 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 206.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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