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244422

Sigma-Aldrich

1-Hexyne

97%

Synonym(s):

Butylacetylene, n-Butylacetylene

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About This Item

Linear Formula:
CH3(CH2)3C≡CH
CAS Number:
693-02-7
Molecular Weight:
82.14
Beilstein:
635687
EC Number:
211-736-9
MDL number:
MFCD00009504
UNSPSC Code:
12352100
eCl@ss:
39010407
PubChem Substance ID:
24854675
NACRES:
NA.22

vapor pressure

253 mmHg ( 37.7 °C)

Assay

97%

form

liquid

impurities

<2% 1-bromobutane

refractive index

n20/D 1.399 (lit.)

bp

71-72 °C (lit.)

mp

−132 °C (lit.)

density

0.715 g/mL at 25 °C (lit.)

SMILES string

CCCCC#C

InChI

1S/C6H10/c1-3-5-6-4-2/h1H,4-6H2,2H3

InChI key

CGHIBGNXEGJPQZ-UHFFFAOYSA-N

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General description

1-Hexyne reacted with thianthrene cation radical tetrafluoroborate to form trans-1,2-bis(5-thianthreniumyl)alkene tetrafluoroborate.

Application

1-Hexyne was used in the synthesis of a tricyclic isoindolinone scaffold by undergoing hydrozirconation and ring-closing metathesis (RCM).

Signal Word

Danger

Hazard Statements

H225,H304,H315,H319,H335

Hazard Classifications

Asp. Tox. 1 - Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

-4.0 °F - closed cup

Flash Point(C)

-20 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Bettina Miller et al.
Beilstein journal of organic chemistry, 8, 1091-1097 (2012-09-29)
Hydrozirconation of 1-hexyne, the addition to in situ prepared N-acyliminium species, and ring-closing metathesis (RCM) were key steps in the preparation of a tricyclic isoindolinone scaffold. An unusual alkene isomerization process during the RCM was identified and studied in some
Mauricio M Victor et al.
Medicinal chemistry (Shariqah (United Arab Emirates)), 15(4), 400-408 (2018-10-27)
The trypanosomatids, such as the protozoan Leishmania spp., have a demand by ergosterol, which is not present in the membrane from mammal cells. The suppression of the synthesis of ergosterol would be a new target of compounds with leishmanicidal activity
David A Bichara et al.
The Journal of arthroplasty, 33(8), 2666-2670 (2018-05-23)
Wear resistance of ultrahigh molecular weight polyethylene (UHMWPE) is improved via ionizing radiation crosslinking and subsequent high temperature melting for improved toughness. Our group has previously reported that crosslinking can also be achieved chemically using organic peroxides. However, volatile peroxide
Hyomin Jin et al.
Molecules (Basel, Switzerland), 24(1) (2019-01-10)
Herein, we investigated the effect of ring planarity by fully characterizing four pyridine-based o-carboranyl compounds. o-Carborane was introduced to the C4 position of the pyridine rings of 2-phenylpyridine and 2-(benzo[b]thiophen-2-yl)pyridine (CB1 and CB2, respectively), and the compounds were subsequently borylated
Davide Albani et al.
Nature communications, 9(1), 2634-2634 (2018-07-08)
Ensemble control has been intensively pursued for decades to identify sustainable alternatives to the Lindlar catalyst (PdPb/CaCO3) applied for the partial hydrogenation of alkynes in industrial organic synthesis. Although the geometric and electronic requirements are known, a literature survey illustrates
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