Fenuron - analytical standard , CAS No.101-42-8

CAS: 101-42-8 Cat. No.: F114583 Formula: C9H12N2O Molecular Weight: 164.2 EC Number: 202-941-4
AVAILABLE TO ORDER
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
CAS-101-42-8 | HSDB 6639 | A897162 | Fenuron, PESTANAL(R), analytical standard | HEPTYLBUTYRATE | Fenulon | Fenuron 10 microg/mL in Acetonitrile | AKOS001178467 | AS-59690 | Croptex Chrome | Dyhard RU 300 | Fenuron [ANSI:BSI:ISO] | Fikure 62U | Fenuron;1,
Storage
Room temperature
Shipped In
Normal
Size
USA
Germany (EU)*
Price
Qty
250mg
F114583-250mg
Made to order · 8–12 wks

$180.90

$239.90
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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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
CAS-101-42-8 | HSDB 6639 | A897162 | Fenuron, PESTANAL(R), analytical standard | HEPTYLBUTYRATE | Fenulon | Fenuron 10 microg/mL in Acetonitrile | AKOS001178467 | AS-59690 | Croptex Chrome | Dyhard RU 300 | Fenuron [ANSI:BSI:ISO] | Fikure 62U | Fenuron;1,
Specifications & Purity
analytical standard
Storage
Room temperature
Shipped In
Normal
Grade
Analytical standard
Names and Identifiers
Canonical SmilesCN(C)C(=O)NC1=CC=CC=C1
IUPAC Name1,1-dimethyl-3-phenylurea
InChIKeyXXOYNJXVWVNOOJ-UHFFFAOYSA-N
INCHI1S/C9H12N2O/c1-11(2)9(12)10-8-6-4-3-5-7-8/h3-7H,1-2H3,(H,10,12)
Isomeric SMILES CN(C)C(=O)NC1=CC=CC=C1
Molecular Weight 164.2
Reaxy-Rn 2208535
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2208535&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
ClassBenzene and substituted derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzene and substituted derivatives
Alternative Parents Isoureas  Propargyl-type 1,3-dipolar organic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Monocyclic benzene moiety - Isourea - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
External Descriptors Phenylurea herbicides
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
GNAS Tbio Guanine nucleotide-binding protein G(s), subunit alpha (103405 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
POLK Tbio DNA polymerase kappa (8653 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
POLI Tchem DNA polymerase iota (116820 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
psbA Photosystem Q(B) protein (72 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SolubilitySlightly soluble in water and hydrocarbons, easily soluble in alcohols and ketones.
Melt Point(°C)134~136℃
Molecular Weight164.200 g/mol
XLogP31.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass164.095 Da
Monoisotopic Mass164.095 Da
Topological Polar Surface Area32.299 Ų
Heavy Atom Count12
Formal Charge0
Complexity151.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Documents & Articles
Citations of This Product
References
1. Liu Yaqing, Lin Xiaodong, Ji Xiangyi, Hao Zhe, Tao Zhanhui.  (2020)  Smartphone-based enzyme-free fluorescence sensing of organophosphate DDVP.  MICROCHIMICA ACTA,  187  (7): (1-8).  [PMID:32613298] [10.1007/s00604-020-04384-7]
Solution Calculators
Reviews

Customer Reviews

📚 Citations by Application

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