ChemicalBook--->CAS DataBase List--->590-93-2

590-93-2

590-93-2 Structure

590-93-2 Structure
IdentificationMore
[Name]

2-Butynoic acid
[CAS]

590-93-2
[Synonyms]

2-BUTYNOIC ACID
BUT-2-YNOIC ACID
TETROLIC ACID
1-Propynecarboxylic acid
3-Methylpropiolic acid
2-Butynoicacid,98%
2-BUTYNOIC ACID 98%
Methylacetylenecarboxylic acid
Methylpropynoic acid
Butynoic acid
Methylpropiolic acid
[EINECS(EC#)]

209-695-7
[Molecular Formula]

C4H4O2
[MDL Number]

MFCD00004363
[Molecular Weight]

84.07
[MOL File]

590-93-2.mol
Chemical PropertiesBack Directory
[Appearance]

white to yellow powder
[Melting point ]

78-80 °C (lit.)
[Boiling point ]

200-203°C
[density ]

0,9641 g/cm3
[refractive index ]

1.3918 (estimate)
[Fp ]

200-203°C
[storage temp. ]

Sealed in dry,2-8°C
[solubility ]

water: soluble50mg/mL, clear to very slightly hazy, colorless to very faintly yellow
[form ]

Powder
[pka]

2.62(at 25℃)
[color ]

White to yellow
[Water Solubility ]

Soluble in water. Slightly soluble in methanol and chloroform.
[Detection Methods]

T,NMR
[BRN ]

1740205
[InChI]

1S/C4H4O2/c1-2-3-4(5)6/h1H3,(H,5,6)
[InChIKey]

LUEHNHVFDCZTGL-UHFFFAOYSA-N
[SMILES]

CC#CC(O)=O
[CAS DataBase Reference]

590-93-2(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Butynoic acid(590-93-2)
[EPA Substance Registry System]

590-93-2(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314
[Precautionary statements ]

P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S27:Take off immediately all contaminated clothing .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 3261 8/PG 2
[WGK Germany ]

3
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29161900
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Eye Dam. 1
Skin Corr. 1B
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Propyne-->Carbon dioxide
[Preparation Products]

Ethyl 2-butynoate-->2,3-Dibromobutyric acid-->Methyl 2-butynoate
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Butynoic acid(590-93-2).msds
Hazard InformationBack Directory
[Chemical Properties]

white to yellow powder
[Uses]

Synthon employed in a variety of reactions, including cycloacylation of phenols to flavones and chromones,1 and cyclization to γ-butyrolactones.2
[Preparation]

2-Butynic acid is synthesised from propyne and carbon dioxide.
[General Description]

The rotational spectrum of 2-butynoic acid was measured by pulsed supersonic-jet Fourier transform microwave spectroscopy.
Spectrum DetailBack Directory
[Spectrum Detail]

2-Butynoic acid(590-93-2)1HNMR
2-Butynoic acid(590-93-2)Raman
2-Butynoic acid(590-93-2)FT-IR
2-Butynoic acid(590-93-2)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Butynoic acid, 98%(590-93-2)
[Alfa Aesar]

2-Butynoic acid, 98%(590-93-2)
[Sigma Aldrich]

590-93-2(sigmaaldrich)
[TCI AMERICA]

Tetrolic Acid,>95.0%(T)(590-93-2)
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