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Merck
CN

212997

2-Phenyl-3-butyn-2-ol

≥98%

Synonym(s):

α-Ethynyl-α-methylbenzenemethanol, 2-Hydroxy-2-phenyl-3-butyne, 2-Phenyl-2-hydroxy-3-butyne, 3-Hydroxy-3-phenyl-1-butyne, 3-Phenyl-1-butyn-3-ol, 3-Phenylbutyn-3-ol, Ethynylmethylphenylcarbinol, Methylphenylethynylcarbinol

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About This Item

Linear Formula:
C6H5C(CH3)(OH)C≡CH
CAS Number:
Molecular Weight:
146.19
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
204-855-2
Beilstein/REAXYS Number:
1100096
MDL number:
Assay:
≥98%
Form:
solid
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Quality Level

assay

≥98%

form

solid

bp

102-103 °C/12 mmHg (lit.)

mp

47-49 °C (lit.)

functional group

hydroxyl, phenyl

SMILES string

CC(O)(C#C)c1ccccc1

InChI

1S/C10H10O/c1-3-10(2,11)9-7-5-4-6-8-9/h1,4-8,11H,2H3

InChI key

KSLSOBUAIFEGLT-UHFFFAOYSA-N

Application

2-Phenyl-3-butyn-2-ol was used in the preparation of :
  • (3-methyl-5-isoxazolyl)(phenyl)-methanol
  • 1-(3-methyl-5-isoxazolyl)-1-phenyl-1-ethanol
  • α-methylene cyclic carbonates via reaction with CO2 catalyzed by transition metal salts in ionic liquid
  • copper (II)-promoted cycloaddtion to azides leading to triazoles


pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

204.8 °F - closed cup

flash_point_c

96 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves



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Synlett, 957-957 (2006)
New 5-(2-ethenylsubstituted)-3 (2H)-furanones with in vitro antiproliferative activity.
Chimichi S, et al.
Tetrahedron, 59(28), 5215-5223 (2003)
Yanlong Gu et al.
The Journal of organic chemistry, 69(2), 391-394 (2004-01-17)
Reactions of propargylic alcohols with CO(2) in a [BMIm][PhSO(3)]/CuCl catalytic system to produce the corresponding alpha-methylene cyclic carbonates were conducted with high yields. Mild reaction conditions, enhanced rates, improved yields, and recyclable ionic liquid catalyst systems are the remarkable features



Global Trade Item Number

SKUGTIN
212997-100G04061833540503
212997-25G04061833540510
212997-5G04061838772534