2,5-dimethyl-4-nitrophenol - ≥98% , CAS No.3139-05-7

CAS: 3139-05-7 Cat. No.: D333669 Fórmula: C8H9NO3 Peso molecular: 167.16 Número EC: 963-348-0
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
NSC135201 | NSC-135201 | 2,5-Dimethyl-4-nitrophenol | 4-Nitro-3,6-xylenol | DS-14510 | AM20061128 | DTXSID40300177 | 4-nitro-2,5-dimethylphenol | 4-nitro-2,5-xylenol | 2,5-dimethyl-4-hydroxynitrobenzene | SY005033 | CK1187 | F0001-0945 | Phenol, 2,5-dimet
Storage
Room temperature
Shipped In
Normal
★
Size
Alemania (EU)
USA*
Price
Qty
1g
D333669-1g
—
5 Disponible

8,59€

12,93€
Guardar 4,34 € (33.56%)
5g
D333669-5g
—
Disponible ≥10

29,42€

44,17€
Guardar 14,75 € (33.40%)
25g
D333669-25g
—
5 Disponible

122,26€

183,87€
Guardar 61,61 € (33.51%)
100g
D333669-100g
—
1 Disponible

369,57€

554,40€
Guardar 184,83 € (33.34%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98% 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
NSC135201 | NSC-135201 | 2,5-Dimethyl-4-nitrophenol | 4-Nitro-3,6-xylenol | DS-14510 | AM20061128 | DTXSID40300177 | 4-nitro-2,5-dimethylphenol | 4-nitro-2,5-xylenol | 2,5-dimethyl-4-hydroxynitrobenzene | SY005033 | CK1187 | F0001-0945 | Phenol, 2,5-dimet
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%
Nombres e identificadores
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/508807766
Sonrisas canónicas
CC1=CC(=C(C=C1O)C)[N+](=O)[O-]
IUPAC Name
2,5-dimethyl-4-nitrophenol
InChIKey
DSWZKAODNLLINU-UHFFFAOYSA-N
INCHI
1S/C8H9NO3/c1-5-4-8(10)6(2)3-7(5)9(11)12/h3-4,10H,1-2H3
Isómeros SMILES
CC1=CC(=C(C=C1O)C)[N+](=O)[O-]
Peso molecular
167.16
Reaxy-Rn
2092463
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2092463&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
ClasePhenols
SubclassNitrophenols
Intermediate Tree Nodes Not available
Direct ParentNitrophenols
Alternative Parents p-Xylenols  Nitrotoluenes  Nitrobenzenes  p-Xylenes  Ortho cresols  Nitroaromatic compounds  Meta cresols  1-hydroxy-2-unsubstituted benzenoids  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Nitrophenol - Nitrobenzene - Nitrotoluene - Xylenol - P-xylenol - M-cresol - P-xylene - Xylene - Nitroaromatic compound - O-cresol - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as nitrophenols. These are compounds containing a nitrophenol moiety, which consists of a benzene ring bearing both a hydroxyl group and a nitro group on two different ring carbon atoms.
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.

4 results found

Lot NumberCertificate TypeFechaArticulo
F2204197Certificate of AnalysisMar 03, 2025 D333669
F2204216Certificate of AnalysisMar 03, 2025 D333669
F2204230Certificate of AnalysisMar 03, 2025 D333669
F2204231Certificate of AnalysisMar 03, 2025 D333669
Propiedades químicas y físicas
Índice de refracciónn20D1.59 (Predicted)
Punto de ebullición (°C)~316.1° C at 760 mmHg (Predicted)
Punto de fusión (°C)96.65° C (Predicted)
Peso molecular167.160 g/mol
XLogP32.100
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass167.058 Da
Monoisotopic Mass167.058 Da
Topological Polar Surface Area66.100 Ų
Heavy Atom Count12
Formal Charge0
Complexity178.000
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
Calculadoras de soluciones
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