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Prueba documental

Citado en 37 publicaciones revisadas por pares sobre cromatografía, síntesis orgánica y reacciones de acoplamiento cruzado.

Especificaciones

Sinónimos

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥95%

Nombres e identificadores

Pubchem Sid

508810441

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508810441

Sonrisas canónicas

CC1=CCC(CC1)C(=C)C

IUPAC Name

1-methyl-4-prop-1-en-2-ylcyclohexene

InChIKey

XMGQYMWWDOXHJM-UHFFFAOYSA-N

INCHI

1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3

Isómeros SMILES

CC1=CCC(CC1)C(=C)C

Peso molecular

136.234

Reaxy-Rn

774123

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774123&ln=

Documentación

📋 Hoja de datos de seguridad (SDS)

Documento completo sobre peligros, manipulación, almacenamiento y cumplimiento normativo.

<<<<<<< HEAD Descargar SDS → ======= Descargar SDS → >>>>>>> release248-p3

✅ Certificado de análisis (COA)

Datos de calidad específicos del lote. Introduzca su número de lote para obtener el COA exacto.

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📊 Ficha técnica

Resumen de referencia rápida de las especificaciones y aplicaciones del producto.

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🔬 Hoja de especificaciones

Atributos de calidad completos y criterios de aceptación para esta calidad.

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Datos avanzados

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Clase Prenol lipids
    - Subclass Monoterpenoids

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Clase	Prenol lipids
Subclass	Monoterpenoids
Intermediate Tree Nodes	Not available
Direct Parent	Menthane monoterpenoids
Alternative Parents	Monocyclic monoterpenoids Branched unsaturated hydrocarbons Cycloalkenes Unsaturated aliphatic hydrocarbons
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	P-menthane monoterpenoid - Monocyclic monoterpenoid - Branched unsaturated hydrocarbon - Cycloalkene - Cyclic olefin - Unsaturated aliphatic hydrocarbon - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aliphatic homomonocyclic compound
Descripción	This compound belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes.
External Descriptors	a limonene
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

Estructura 3D

Objetivos asociados (humanos)

THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)

Discover Target: THRB

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

RXRA Tclin Retinoid X receptor alpha (3637 Activities)

Discover Target: RXRA

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

TP53 Tchem Cellular tumor antigen p53 (48468 Activities)

Discover Target: TP53

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

A498 (42825 Activities)

Lot Number	Certificate Type	Fecha	Articulo
H2611334	Certificate of Analysis	Jul 18, 2026	D304599
H2611182	Certificate of Analysis	Jul 18, 2026	D304599
G2618161	Certificate of Analysis	Apr 10, 2026	D304599
D2622223	Certificate of Analysis	Apr 10, 2026	D304599
D2622224	Certificate of Analysis	Apr 10, 2026	D304599
D2622258	Certificate of Analysis	Apr 10, 2026	D304599
F23151071	Certificate of Analysis	Mar 18, 2026	D304599
F23151034	Certificate of Analysis	Mar 18, 2026	D304599
J2511359	Certificate of Analysis	Sep 19, 2025	D304599
J2511358	Certificate of Analysis	Sep 19, 2025	D304599
J2511357	Certificate of Analysis	Sep 19, 2025	D304599
G2529163	Certificate of Analysis	Jul 11, 2025	D304599
G2529266	Certificate of Analysis	Jul 11, 2025	D304599
G2529265	Certificate of Analysis	Jul 11, 2025	D304599
C2605196	Certificate of Analysis	Jul 11, 2025	D304599
C2510120	Certificate of Analysis	Feb 28, 2025	D304599
C2510121	Certificate of Analysis	Feb 28, 2025	D304599
C2510122	Certificate of Analysis	Feb 28, 2025	D304599
H2415353	Certificate of Analysis	Aug 02, 2024	D304599
H2415352	Certificate of Analysis	Aug 02, 2024	D304599
H2415332	Certificate of Analysis	Aug 02, 2024	D304599
C2407426	Certificate of Analysis	Feb 26, 2024	D304599
C2407431	Certificate of Analysis	Feb 26, 2024	D304599
C2407432	Certificate of Analysis	Feb 26, 2024	D304599
B2510007	Certificate of Analysis	Feb 26, 2024	D304599
J2312594	Certificate of Analysis	Sep 23, 2023	D304599
J2312597	Certificate of Analysis	Sep 23, 2023	D304599
J2312599	Certificate of Analysis	Sep 23, 2023	D304599
F23151052	Certificate of Analysis	Jun 02, 2023	D304599
I2306035	Certificate of Analysis	Jun 02, 2023	D304599
F23151038	Certificate of Analysis	Jun 02, 2023	D304599
F23151037	Certificate of Analysis	Jun 02, 2023	D304599
H2224193	Certificate of Analysis	Jul 28, 2022	D304599
H2224194	Certificate of Analysis	Jul 28, 2022	D304599
H2224192	Certificate of Analysis	Jul 28, 2022	D304599
D2307416	Certificate of Analysis	Jul 28, 2022	D304599
E2319194	Certificate of Analysis	Jul 28, 2022	D304599
F2221251	Certificate of Analysis	Nov 19, 2021	D304599

Punto de inflamación (°C)	45℃
Punto de ebullición (°C)	176℃
Punto de fusión (°C)	-97℃
Peso molecular	136.230 g/mol
XLogP3	3.400
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	136.125 Da
Monoisotopic Mass	136.125 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	163.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

D-Limonene - ≥95% , CAS No.7705-14-8

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