2-Amyl-5-methylphenol - 10mM in DMSO , CAS No.1300-94-3

CAS: 1300-94-3 Cat. No.: A421174 Summenformel: C12H18O Molekulargewicht: 178.28 EG-Nummer: 215-094-0
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GRADE & PURITY 10mM in DMSO
Synonyms
05W904P57F | Amylmetacresol [INN:BAN] | 6-Pentyl-m-cresol | NCGC00180998-01 | Tox21_112651 | FT-0620948 | 6-N-AMYL-M-CRESOL [MI] | AKOS015912095 | EN300-7404783 | UNII-05W904P57F | Amylmetacresol; 5-Methyl-2-pentylphenol | 5-methyl-2-N-pentylphenol, Aldri
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
★
Size
Deutschland (EU)
USA*
Price
Qty
1ml
A421174-1ml
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2 Auf Lager

41,56€

60,65€
Speichern 19,09 € (31.47%)
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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs 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

Synonyme
05W904P57F | Amylmetacresol [INN:BAN] | 6-Pentyl-m-cresol | NCGC00180998-01 | Tox21_112651 | FT-0620948 | 6-N-AMYL-M-CRESOL [MI] | AKOS015912095 | EN300-7404783 | UNII-05W904P57F | Amylmetacresol; 5-Methyl-2-pentylphenol | 5-methyl-2-N-pentylphenol, Aldri
Spezifikationen & Reinheit
10mM in DMSO
Storage
Store at -80°C
Verschickt in
Dry ice packs + Cold packs
Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.
Aktionsart
INHIBITOR
Produkteigenschaften
ALogP4.4
Namen und Kennungen
Pubchem Sid528756392
Kanonisches LächelnCCCCCC1=C(C=C(C=C1)C)O
IUPAC Name5-methyl-2-pentylphenol
InChIKeyCKGWFZQGEQJZIL-UHFFFAOYSA-N
INCHI1S/C12H18O/c1-3-4-5-6-11-8-7-10(2)9-12(11)13/h7-9,13H,3-6H2,1-2H3
Isomere SMILES CCCCCC1=C(C=C(C=C1)C)O
RTECS GP3100000
Molekulargewicht 178.28
Reaxy-Rn 2440952
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2440952&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
KlassePhenols
SubclassCresols
Intermediate Tree Nodes Not available
Direct ParentMeta cresols
Alternative Parents Toluenes  1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Organooxygen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents M-cresol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Toluene - Monocyclic benzene moiety - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as meta cresols. These are aromatic compounds containing a meta-cresol moiety, which consists of a benzene ring bearing a methyl group and a hydroxyl group at ring positions 1 and 3, respectively.
External Descriptors phenols
3D-Struktur
Interaktives chemisches Strukturmodell





Zugehörige Ziele (menschlich)
USP1 Tchem Ubiquitin carboxyl-terminal hydrolase 1 (22556 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Zugehörige Ziele (nicht menschlich)
Rorc Nuclear receptor ROR-gamma (89407 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Wirkungsmechanismen
Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemische und physikalische Eigenschaften
Empfindlichkeitair sensitive
Brechungsindex1.51
Flammpunkt (°C)125 °C
Siedepunkt (°C)139°C/15mmHg(lit.)
Molekulargewicht178.270 g/mol
XLogP34.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass178.136 Da
Monoisotopic Mass178.136 Da
Topological Polar Surface Area20.200 Ų
Heavy Atom Count13
Formal Charge0
Complexity133.000
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
Lösungsrechner
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