Buturon - analytical standard , CAS No.3766-60-7

CAS: 3766-60-7 Cat. No.: B114773 Peso molecular: 236.7 Beilstein Registry Number: 2941811 Número EC: 223-187-2
Disponible para pedir
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
BRN 2941811 | H-951 | 1961BJU91F | UNII-1961BJU91F | HS-95 | Buturon, PESTANAL(R), analytical standard | HS 95 | DTXSID5041699 | EPA Pesticide Chemical Code 207600 | 3-(but-3-yn-2-yl)-1-(4-chlorophenyl)-3-methylurea | Arisan | Urea, N'-(4-chlorophenyl)-N-
Storage
Room temperature
Shipped In
Normal
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Size
Estado
Price
Qty
100mg
B114773-100mg
2

226,90US$

264,90US$
Guardar 38,00 US$ (14.35%)
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Why this grade

analytical standard Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 19 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
BRN 2941811 | H-951 | 1961BJU91F | UNII-1961BJU91F | HS-95 | Buturon, PESTANAL(R), analytical standard | HS 95 | DTXSID5041699 | EPA Pesticide Chemical Code 207600 | 3-(but-3-yn-2-yl)-1-(4-chlorophenyl)-3-methylurea | Arisan | Urea, N'-(4-chlorophenyl)-N-
Especificaciones y pureza
analytical standard
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Grado
Analytical standard
Nombres e identificadores
Sonrisas canónicasCC(C#C)N(C)C(=O)NC1=CC=C(C=C1)Cl
IUPAC Name1-but-3-yn-2-yl-3-(4-chlorophenyl)-1-methylurea
InChIKeyBYYMILHAKOURNM-UHFFFAOYSA-N
INCHI1S/C12H13ClN2O/c1-4-9(2)15(3)12(16)14-11-7-5-10(13)6-8-11/h1,5-9H,2-3H3,(H,14,16)
Isómeros SMILES CC(C#C)N(C)C(=O)NC1=CC=C(C=C1)Cl
WGK Alemania 3
RTECS YS6475000
Peso molecular 236.7
Beilstein 2941811
Reaxy-Rn 2941811
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2941811&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassN-phenylureas
Intermediate Tree Nodes Not available
Direct ParentN-phenylureas
Alternative Parents Chlorobenzenes  Aryl chlorides  Ureas  Acetylides  Organopnictogen compounds  Organonitrogen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents N-phenylurea - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Urea - Carbonic acid derivative - Acetylide - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Aromatic homomonocyclic compound
DescripciónThis 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
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

2 results found

Lot NumberCertificate TypeFechaArticulo
K2230284Certificate of AnalysisJun 09, 2026 B114773
C2226094Certificate of AnalysisSep 08, 2025 B114773
Propiedades químicas y físicas
Punto de inflamación (°F)>100 °C
Punto de inflamación (°C)>100°C
Peso molecular236.700 g/mol
XLogP33.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass236.072 Da
Monoisotopic Mass236.072 Da
Topological Polar Surface Area32.299 Ų
Heavy Atom Count16
Formal Charge0
Complexity289.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Referencias
1. YueYue Zhang, Jinjuan Wang, Ang Yu, Yuanfei Wu, Xiaojia Huang.  (2023)  Green fabrication of fly ash-based magnetic adsorbent under water medium for the simultaneous capture of phenylurea and sulfonylurea herbicides prior to chromatographic quantification.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2023.109776]
2. Linna Guo, Miao Tian, Zhi Li, Qianqian Wang, Qiuhua Wu, Lin Hao, Chun Wang.  (2023)  Preparation of hypercrosslinked porous polymer with manifold functional groups for sensitive determination of phenylurea herbicides in beverages and celtuce samples.  FOOD CHEMISTRY,      [PMID:37385066] [10.1016/j.foodchem.2023.136674]
3. Jiangyi Wu, Siyu Luo, Xiaojia Huang.  (2022)  Fabrication of monolith-based electrodes for simultaneous solid-phase microextraction of phenylurea and sulfonylurea herbicides assisted by electric field.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2022.140786]
4. Kaisheng Hong, Youfang Huang, Lingxin Zheng, Xinyi Zheng, Xiaojia Huang.  (2022)  One-pot fabrication of poly (ionic liquid)s functionalized magnetic adsorbent for efficient enrichment of phenylurea herbicides in environmental waters.  ANALYTICA CHIMICA ACTA,      [PMID:35190134] [10.1016/j.aca.2022.339549]
5. Weihua Liu, Juntao Wang, Shuangju Song, Lin Hao, Jiajia Liu, Yangjuan An, Yaxing Guo, Qiuhua Wu, Chun Wang, Zhi Wang.  (2021)  Facile synthesis of uniform spherical covalent organic frameworks for determination of neonicotinoid insecticides.  FOOD CHEMISTRY,      [PMID:34343809] [10.1016/j.foodchem.2021.130653]
6. Mingming Xu, Yangjuan An, Qianqian Wang, Junmin Wang, Lin Hao, Chun Wang, Zhi Wang, Junhong Zhou, Qiuhua Wu.  (2021)  Construction of hydroxyl functionalized magnetic porous organic framework for the effective detection of organic micropollutants in water, drink and cucumber samples.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:33951875] [10.1016/j.jhazmat.2021.125307]
7. Qiuhua Wu, Yuhong Song, Qianqian Wang, Weihua Liu, Lin Hao, Zhi Wang, Chun Wang.  (2020)  Combination of magnetic solid-phase extraction and HPLC-UV for simultaneous determination of four phthalate esters in plastic bottled juice.  FOOD CHEMISTRY,      [PMID:32858384] [10.1016/j.foodchem.2020.127855]
8. Wang Qianqian, Li Gaigai, Wang Chun, Wu Qiuhua, Wang Zhi.  (2020)  Layered porous organic frameworks as a novel adsorbent for the solid phase extraction of chlorophenols prior to their determination by HPLC-DAD.  MICROCHIMICA ACTA,  187  (4): (1-11).  [PMID:32152748] [10.1007/s00604-020-4195-x]
9. Gao Tian, Wang Junmin, Hao Lin, Yang Xiumin, Wang Chun, Wu Qiuhua, Wang Zhi.  (2018)  A magnetic knitting aromatic polymer as a new sorbent for use in solid-phase extraction of organics.  MICROCHIMICA ACTA,  185  (12): (1-9).  [PMID:30460410] [10.1007/s00604-018-3085-y]
10. Yao Wang, Ruobai Xiao, Ershun Yang, Qiuhua Wu, Chun Wang, Zhi Wang.  (2018)  Phthalocyanine-containing polymer derived porous carbon as a solid-phase extraction adsorbent for the enrichment of phenylurea herbicides from water and vegetable samples.  Separation Science Plus,  (5): (359-366).  [PMID:] [10.1002/sscp.201700029]
11. Xinyu Liang, Juntao Wang, Qiuhua Wu, Chun Wang, Zhi Wang.  (2018)  Use of a hypercrosslinked triphenylamine polymer as an efficient adsorbent for the enrichment of phenylurea herbicides.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:29397984] [10.1016/j.chroma.2018.01.033]
12. Juntao Wang, Menghua Li, Caina Jiao, Yuhong Song, Chun Wang, Qiuhua Wu, Zhi Wang.  (2017)  Preparation of a magnetic porous organic polymer for the efficient extraction of phenylurea herbicides.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:28888678] [10.1016/j.chroma.2017.09.001]
13. Juanjuan Wu, Ruiyang Ma, Lin Hao, Chun Wang, Qiuhua Wu, Zhi Wang.  (2017)  Triphenylamine-based hypercrosslinked organic polymer as adsorbent for the extraction of phenylurea herbicides.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:28903856] [10.1016/j.chroma.2017.09.012]
14. Menghua Li, Juntao Wang, Caina Jiao, Chun Wang, Qiuhua Wu, Zhi Wang.  (2016)  Graphene oxide framework: An adsorbent for solid phase extraction of phenylurea herbicides from water and celery samples.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:27693016] [10.1016/j.chroma.2016.09.056]
15. Sun Meng, Tang Ranxiao, Wu Qiuhua, Wang Chun, Wang Zhi.  (2013)  Graphene Reinforced Hollow Fiber Liquid Phase Microextraction for the Enrichment of some Phenylurea Residues in Milk Sample.  Food Analytical Methods,  (5): (1097-1102).  [PMID:] [10.1007/s12161-013-9719-0]
16. Chenhuan Wang, Qianqian Wang, Kaiyuan Si.  (2025)  Construction of carboxyl-functionalized hyper-cross-linked porous polymers using waste polystyrene for effective adsorption of phenolic contaminants.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:40179671] [10.1016/j.chroma.2025.465925]
17. Hua Wang, Lin Hao, Yaxing Guo, Chun Wang, Qiuhua Wu, Zhi Wang.  (2024)  Construction of magnetic recoverable porous electron-rich organic frameworks for efficiently enrichment of phenylurea herbicides from water and milk samples prior to HPLC detection.  FOOD CHEMISTRY,      [PMID:39178545] [10.1016/j.foodchem.2024.140812]
18. Zichen Zhao, Ruiyang Ma, Juntao Wang, Qing Zhang, Miao Jing, Chun Wang, Qiuhua Wu, Zhi Wang.  (2025)  Preparation of boric acid functionalized hyper-crosslinked polymer for efficient extraction of phenylurea herbicides from lake water, green tea drink and tomato samples.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:40036914] [10.1016/j.chroma.2025.465823]
19. Yaxing Guo, Ruiyang Ma, Weihua Liu, Lin Hao, Qiuhua Wu, Zhi Wang.  (2020)  Facile synthesis of conjugated microporous polymer with spherical structure for solid phase extraction of phenyl urea herbicides.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:32381301] [10.1016/j.chroma.2020.461131]
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