p-Xylene solution - analytical standard, 1.00mg/ml in methanol , CAS No.106-42-3

CAS: 106-42-3 Cat. No.: X103342 Formula: C₈H₁₀ Peso molecolare: 106.17 Numero EC: 203-396-5

QUALITÀ & PUREZZA Analytical standard, 1.00mg/ml in methanol

Synonyms

P-XYLENE|1,4-Dimethylbenzene|Para-Xylene|106-42-3|1,4-Xylene|p-Methyltoluene|p-Dimethylbenzene|p-Xylol|Benzene, 1,4-dimethyl-|4-Xylene|4-Methyltoluene|Chromar|Scintillar|1,4-Dimethylbenzol|paraxylene|CCRIS 910|NSC 72419|HSDB 136|EINECS 203-396-5|UNII-6WAC

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Specifiche

Sinonimi

P-XYLENE | 1,4-Dimethylbenzene | Para-Xylene | 106-42-3 | 1,4-Xylene | p-Methyltoluene | p-Dimethylbenzene | p-Xylol | Benzene, 1,4-dimethyl- | 4-Xylene | 4-Methyltoluene | Chromar | Scintillar | 1,4-Dimethylbenzol | paraxylene | CCRIS 910 | NSC 72419 | HSDB 136 | EINECS 203-396-5 | UNII-6WAC

Specifiche e purezza

analytical standard, 1.00mg/ml in methanol

Condizioni di conservazione di stoccaggio

Store at 2-8°C

Spedito in

Wet ice,FedEx DG Service

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Grado

Standard analitico

Nomi e identificatori

Pubchem Sid

528771418

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528771418

Sorrisi canonici

CC1=CC=C(C=C1)C

IUPAC Name

1,4-xylene

InChIKey

URLKBWYHVLBVBO-UHFFFAOYSA-N

INCHI

1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3

Isomeri SMILES

CC1=CC=C(C=C1)C

WGK Germania

1

Numero UN

1307

Gruppo di imballaggio

III

Peso molecolare

106.17

Reaxy-Rn

1901563

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1901563&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Xylenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Xylenes
• Intermediate Tree Nodes: Not available
• Direct Parent: p-Xylenes
• Alternative Parents: Aromatic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: P-xylene - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as p-xylenes. These are aromatic compounds that contain a p-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 4-positions.
• External Descriptors: an aromatic compound

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

Obiettivi associati (umani)

ACHE Tclin Acetylcholinesterase (1 Activities)

Discover Target: ACHE

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ACHE Tclin Acetylcholinesterase (18204 Activities)

Discover Target: ACHE

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)

Discover Target: PPARG

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Lymphoblastoid cell (5959 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Obiettivi associati (non umani)

Oryctolagus cuniculus (11301 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

E Lysozyme (95 Activities)

Discover Target: E

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Not soluble in water, but miscible with most organic solvents such as ethanol, ether, chloroform, etc.
• Indice di rifrazione: 1.5
• Punto di infiammabilità (°C): 25°C
• Punto di ebollizione (°C): 137-138°C
• Punto di fusione (°C): 13-14°C
• Peso molecolare: 106.160 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 106.078 Da
• Monoisotopic Mass: 106.078 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 48.400
• 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