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6-Dodecyne - ≥98% , CAS No.6975-99-1

6-Dodecyne - ≥98% , CAS No.6975-99-1

Name: 6-Dodecyne - ≥98% , CAS No.6975-99-1
SKU: D155775
Availability: InStock

CAS: 6975-99-1 Cat. No.: D155775 Summenformel: C₁₂H₂₂ Molekulargewicht: 166.31 Beilstein Registry Number: 1(4)1067 EG-Nummer: 675-693-1

COA

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6-Dodecyne - ≥98% CAS No(6975-99-1) by Aladdin Scientific

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GRADE & PURITY ≥98%

Synonyms

D89809 | IHPFQAOOSAGSPN-UHFFFAOYSA-N | Di-n-pentylacetylene | 6-dodecine | dodec-6-yne | D1192 | MFCD00041658 | 6-Dodecyne | NSC20570 | NSC-20570 | FT-0621106 | AKOS006229562 | NSC 20570 | DTXSID80220047 | SY049997

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications Namen und Kennungen Documentation Advanced Data Taxonomic Classification 3D-Struktur Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm) Chemische und physikalische Eigenschaften Lösungsrechner Bewertungen

🧪

Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice 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

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

Kanonisches Lächeln	CCCCCC#CCCCCC
IUPAC Name	dodec-6-yne
InChIKey	IHPFQAOOSAGSPN-UHFFFAOYSA-N
INCHI	1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3-10H2,1-2H3
Isomere SMILES	CCCCCC#CCCCCC
Molekulargewicht	166.31
Beilstein	1(4)1067
Reaxy-Rn	1737397
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1737397&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

Kingdom Organic compounds
- Superclass Hydrocarbons
  - Klasse Unsaturated hydrocarbons
    - Subclass Acetylenes
      - Ebene5 Acyclic acetylenes
        Ebene6 Alkynes
        Ebene7 Terminal alkynes

Kingdom	Organic compounds
Superclass	Hydrocarbons
Klasse	Unsaturated hydrocarbons
Subclass	Acetylenes
Intermediate Tree Nodes	Acyclic acetylenes - Alkynes
Direct Parent	Terminal alkynes
Alternative Parents	Unsaturated aliphatic hydrocarbons
Molecular Framework	Aliphatic acyclic compounds
Substituents	Monosubstituted alkyne - Unsaturated aliphatic hydrocarbon - Aliphatic acyclic compound
Beschreibung	This compound belongs to the class of organic compounds known as terminal alkynes. These are alkynes featuring a carbon substituent on one acetylenic carbon, and a hydrogen on the other carbon.
External Descriptors	Not available
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

3D-Struktur

Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemische und physikalische Eigenschaften

Brechungsindex	1.44
Siedepunkt (°C)	209°C(lit.)
Molekulargewicht	166.300 g/mol
XLogP3	5.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	6
Exact Mass	166.172 Da
Monoisotopic Mass	166.172 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	119.000
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

Lösungsrechner

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