2,4-Dichloro-3-nitrophenol - ≥98% , CAS No.38902-87-3

CAS: 38902-87-3 Cat. No.: D133414 Summenformel: C₆H₃Cl₂NO₃ Molekulargewicht: 208 EG-Nummer: 678-699-2

GRADE & PURITY ≥98%

Synonyms

DTXSID40608286 | GLNRZGZHZYONRE-UHFFFAOYSA-N | AC-7847 | MFCD08059572 | A824324 | 2,4-dichloro-nitrophenol | EN300-110285 | PS-5442 | 2,4-Dichloro-3-nitrophenol | 2,4-dichloro-3-nitro-phenol | E84077 | J-507118 | FT-0639505 | Phenol, 2,4-dichloro-3-nitro-

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

DTXSID40608286 | GLNRZGZHZYONRE-UHFFFAOYSA-N | AC-7847 | MFCD08059572 | A824324 | 2,4-dichloro-nitrophenol | EN300-110285 | PS-5442 | 2,4-Dichloro-3-nitrophenol | 2,4-dichloro-3-nitro-phenol | E84077 | J-507118 | FT-0639505 | Phenol, 2,4-dichloro-3-nitro-

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Kanonisches Lächeln

C1=CC(=C(C(=C1O)Cl)[N+](=O)[O-])Cl

IUPAC Name

2,4-dichloro-3-nitrophenol

InChIKey

GLNRZGZHZYONRE-UHFFFAOYSA-N

INCHI

1S/C6H3Cl2NO3/c7-3-1-2-4(10)5(8)6(3)9(11)12/h1-2,10H

Isomere SMILES

C1=CC(=C(C(=C1O)Cl)[N+](=O)[O-])Cl

Molekulargewicht

208

Reaxy-Rn

3277903

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3277903&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Phenols
      • Subclass Nitrophenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Phenols
• Subclass: Nitrophenols
• Intermediate Tree Nodes: Not available
• Direct Parent: Nitrophenols
• Alternative Parents: Nitrobenzenes P-chlorophenols Dichlorobenzenes Nitroaromatic compounds O-chlorophenols 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organooxygen compounds Organic oxides Organic salts Hydrocarbon derivatives Organochlorides Organonitrogen compounds Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Nitrophenol - Nitrobenzene - Nitroaromatic compound - 1,3-dichlorobenzene - 4-halophenol - 2-halophenol - 4-chlorophenol - 2-chlorophenol - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organic cation - Aromatic homomonocyclic compound
• Beschreibung: This 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

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.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Molekulargewicht: 208.000 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 206.949 Da
• Monoisotopic Mass: 206.949 Da
• Topological Polar Surface Area: 66.100 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 184.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 38902-87-3, the molecular formula is C6H3Cl2NO3, and the molecular weight is 208 g/mol. InChIKey GLNRZGZHZYONRE-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.