MilliporeSigma
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B103209

Sigma-Aldrich

2-Butyne-1,4-diol

99%

Linear Formula:
HOCH2C≡CCH2OH
CAS Number:
Molecular Weight:
86.09
Beilstein:
1071237
EC Number:
MDL number:
PubChem Substance ID:
NACRES:
NA.22

vapor pressure

<0.1 mmHg ( 55 °C)

Quality Level

assay

99%

form

crystals

bp

238 °C (lit.)

mp

53-58 °C (lit.)

SMILES string

OCC#CCO

InChI

1S/C4H6O2/c5-3-1-2-4-6/h5-6H,3-4H2

InChI key

DLDJFQGPPSQZKI-UHFFFAOYSA-N

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Application

2-Butyne-1,4-diol is extensively used in the cycloaddition reactions such as the homologation method for the preparation of substituted acenes, rhodium and iridium-catalyzed [2+ 2+ 2] inter and intramolecular cyclotrimerization. It can also be used in the total synthesis of (−)-isolaurallene, (−)-amphidinolide P and bistramide A.

Packaging

5, 100, 500 g in poly bottle
1, 10 kg

Signal Word

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Eye Dam. 1 - Skin Corr. 1B - Skin Sens. 1 - STOT RE 2

Storage Class Code

6.1C - Combustible, acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 2

Flash Point(F)

305.6 °F - closed cup

Flash Point(C)

152 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificate of Analysis

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Certificate of Origin

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