4-lsopropyltoluene - Standard for GC, ≥99.5%(GC) , CAS No.99-87-6

CAS: 99-87-6 Cat. No.: I105451 Fórmula: C10H14 Peso molecular: 134.2 Beilstein Registry Number: 1903377 Número EC: 202-796-7
Disponible para pedir
GRADE & PURITY Standard for GC ? GC reference standard — characterized compound for calibrating GC methods. Use to build calibration curves and verify GC quantitation. ≥99.5%(GC)
Synonyms
p-Mentha-1,3,5-triene | 1-Isopropyl-4-methylbenzene | 1-isopropyl-4-methyl-Benzene | Benzene, 1-isopropyl-4-methyl- | MML | p-Isopropylmethylbenzene | 2-p-Tolylpropane | EINECS 202-796-7 | p-Cymene [UN2046] [Flammable liquid] | s5598 | benzene, 1-methyl-
Storage
Room temperature
Shipped In
FedEx DG Service
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Size
USA
Alemania (EU)*
Price
Qty
5ml
I105451-5ml
Disponible ≥10
7 Disponible

21,90US$

32,90US$
Guardar 11,00 US$ (33.43%)
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Why this grade

Standard for GC, ≥99.5%(GC) Standard for GC for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships FedEx DG Service Check lot-specific COA for exact specifications.

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Quality documents

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

📚

Literature proof

Cited in 30 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
p-Mentha-1,3,5-triene | 1-Isopropyl-4-methylbenzene | 1-isopropyl-4-methyl-Benzene | Benzene, 1-isopropyl-4-methyl- | MML | p-Isopropylmethylbenzene | 2-p-Tolylpropane | EINECS 202-796-7 | p-Cymene [UN2046] [Flammable liquid] | s5598 | benzene, 1-methyl-
Especificaciones y pureza
Standard for GC, ≥99.5%(GC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
FedEx DG Service
Grado
Standard for GC
Pureza
≥99.5%(GC)
Nombres e identificadores
Pubchem Sid
Sonrisas canónicas
CC1=CC=C(C=C1)C(C)C
IUPAC Name
1-methyl-4-propan-2-ylbenzene
InChIKey
HFPZCAJZSCWRBC-UHFFFAOYSA-N
INCHI
1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3
Isómeros SMILES
CC1=CC=C(C=C1)C(C)C
WGK Alemania
2
RTECS
GZ5950000
Número ONU
2046
Grupo de embalaje
III
Peso molecular
134.2
Beilstein
1903377
Reaxy-Rn
1903377
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1903377&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
SuperclassLipids and lipid-like molecules
ClasePrenol lipids
SubclassMonoterpenoids
Intermediate Tree Nodes Not available
Direct ParentAromatic monoterpenoids
Alternative Parents Monocyclic monoterpenoids  Phenylpropanes  Cumenes  Toluenes  Aromatic hydrocarbons  Unsaturated hydrocarbons  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Monocyclic monoterpenoid - Aromatic monoterpenoid - P-cymene - Phenylpropane - Cumene - Toluene - Benzenoid - Monocyclic benzene moiety - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring.
External Descriptors a monoterpenoid
Estructura 3D
Modelo de Estructura Química Interactiva





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Mecanismos de acción
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
L2510405Certificate of AnalysisDec 31, 2025 I105451
J2531149Certificate of AnalysisNov 10, 2025 I105451
D2508085Certificate of AnalysisApr 18, 2025 I105451
E2409088Certificate of AnalysisMay 16, 2024 I105451
J2312018Certificate of AnalysisOct 19, 2023 I105451
K2212466Certificate of AnalysisNov 15, 2022 I105451
G2222384Certificate of AnalysisJul 26, 2022 I105451
Propiedades químicas y físicas
Índice de refracción1.49
Punto de inflamación (°C)47°C
Punto de ebullición (°C)177.1°C
Punto de fusión (°C)-67.94°C
Peso molecular134.220 g/mol
XLogP34.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass134.11 Da
Monoisotopic Mass134.11 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count10
Formal Charge0
Complexity86.200
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
Preguntas frecuentes y artículos
Citations of This Product
Calculadoras de soluciones
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