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5-Dodecyne - ≥98% , CAS No.19780-12-2

5-Dodecyne - ≥98% , CAS No.19780-12-2

Name: 5-Dodecyne - ≥98% , CAS No.19780-12-2
SKU: D155795
Availability: InStock

CAS: 19780-12-2 Cat. No.: D155795 Formule: C₁₂H₂₂ Poids moléculaire: 166.31 Numéro CE: 679-716-6

COA

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5-Dodecyne - ≥98% CAS No(19780-12-2) by Aladdin Scientific

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DISPONIBLE À COMMANDE

GRADE & PURITY ≥98%

Synonyms

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications Noms et identifiants Documentation Advanced Data Taxonomic Classification Structure 3D Certificats (CoA, COO, BSE/TSE et tableau d'analyse) Propriétés chimiques et physiques Calculateurs de solution Avis

🧪

Why this grade

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

🌡

Storage & shipping

Room temperature,Argon charged Ships Normal 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

Synonymes

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature,Argon charged

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

Sourires canoniques	CCCCCCC#CCCCC
IUPAC Name	dodec-5-yne
InChIKey	JQPXWRQCSIYOOP-UHFFFAOYSA-N
INCHI	1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3-9,11H2,1-2H3
Isomères SMILES	CCCCCCC#CCCCC
Poids moléculaire	166.31
Reaxy-Rn	1739509
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1739509&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
  - Classe Unsaturated hydrocarbons
    - Subclass Acetylenes
      - Level5 Acyclic acetylenes
        Level6 Alkynes
        Level7 Terminal alkynes

Kingdom	Organic compounds
Superclass	Hydrocarbons
Classe	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
Description	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

Structure 3D

Certificats (CoA, COO, BSE/TSE et tableau d'analyse)

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

Analytical Chart:

Propriétés chimiques et physiques

Sensibilité	Air sensitive
Point d'éclair (°C)	78 °C
Point d'ébullition (°C)	93°C/15mmHg(lit.)
Poids moléculaire	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	133.000
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

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