3-Fluoro-4-methylaniline - ≥99% , CAS No.452-77-7

CAS: 452-77-7 Cat. No.: F122497 Peso molecular: 125.14 Beilstein Registry Number: 2715987 Número EC: 207-212-4
Disponible para pedir
GRADE & PURITY ≥99%
Synonyms
AC-3689 | Benzenamine, 3-fluoro-4-methyl- (9CI) | BRN 2715987 | 3-fluoro-4-methylphenylamine | 3-fluoro-4-methyl-phenylamine | SY013813 | InChI=1/C7H8FN/c1-5-2-3-6(9)4-7(5)8/h2-4H,9H2,1H | 3-Fluoro-p-toluidine | EN300-20223 | FT-0615749 | Z104477330 | 5-C
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5g
F122497-5g
1

13,90US$

20,90US$
Guardar 7,00 US$ (33.49%)
25g
F122497-25g
2

28,90US$

43,90US$
Guardar 15,00 US$ (34.17%)
100g
F122497-100g
2

92,90US$

139,90US$
Guardar 47,00 US$ (33.60%)
500g
F122497-500g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

346,90US$

520,90US$
Guardar 174,00 US$ (33.40%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

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

📋

Quality documents

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

📚

Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
AC-3689 | Benzenamine, 3-fluoro-4-methyl- (9CI) | BRN 2715987 | 3-fluoro-4-methylphenylamine | 3-fluoro-4-methyl-phenylamine | SY013813 | InChI=1/C7H8FN/c1-5-2-3-6(9)4-7(5)8/h2-4H, 9H2, 1H | 3-Fluoro-p-toluidine | EN300-20223 | FT-0615749 | Z104477330 | 5-C
Especificaciones y pureza
≥99%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥99%
Nombres e identificadores
Sonrisas canónicasCC1=C(C=C(C=C1)N)F
IUPAC Name3-fluoro-4-methylaniline
InChIKeyMGRHBBRSAFPBIN-UHFFFAOYSA-N
INCHI1S/C7H8FN/c1-5-2-3-6(9)4-7(5)8/h2-4H,9H2,1H3
Isómeros SMILES CC1=C(C=C(C=C1)N)F
WGK Alemania 3
RTECS XU6825000
Peso molecular 125.14
Beilstein 2715987
Reaxy-Rn 2715987
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2715987&ln=

Documentation

📋 Safety Data Sheet (SDS)

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

Download SDS →

✅ Certificate of Analysis (COA)

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

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassToluenes
Intermediate Tree Nodes Not available
Direct ParentAminotoluenes
Alternative Parents Aniline and substituted anilines  Fluorobenzenes  Aryl fluorides  Primary amines  Organopnictogen compounds  Organofluorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Aminotoluene - Aniline or substituted anilines - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as aminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and one amino group.
External Descriptors Not available
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.

7 results found

Lot NumberCertificate TypeFechaArticulo
C2330183Certificate of AnalysisApr 10, 2023 F122497
C2330226Certificate of AnalysisApr 10, 2023 F122497
C2330679Certificate of AnalysisApr 10, 2023 F122497
I2220340Certificate of AnalysisSep 12, 2022 F122497
I2220349Certificate of AnalysisSep 12, 2022 F122497
I2220431Certificate of AnalysisSep 12, 2022 F122497
I2220433Certificate of AnalysisSep 12, 2022 F122497
Propiedades químicas y físicas
Índice de refracción1.539
Punto de inflamación (°F)192.2 °F
Punto de inflamación (°C)88°C(190°F)
Punto de ebullición (°C)93°C/12mmHg
Punto de fusión (°C)30-32°C
Peso molecular125.140 g/mol
XLogP30.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass125.064 Da
Monoisotopic Mass125.064 Da
Topological Polar Surface Area26.000 Ų
Heavy Atom Count9
Formal Charge0
Complexity94.900
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
Citations of This Product
Referencias
1. Xue Zhang, Xu Tong, Zhiqi Zhou, Changhai Zhang, Tiandong Zhang, Wenju Wu, Chao Wang, Shuya Fu, Chao Yin, Qingguo Chi.  (2026)  Manipulating Polymer Side-Chain Configuration via Substituent Steric Hindrance for Enhanced High-Temperature Capacitive Energy Storage Performance.  ADVANCED FUNCTIONAL MATERIALS,      [PMID:] [10.1002/adfm.202530435]
Calculadoras de soluciones
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