ChemicalBook--->CAS DataBase List--->1577-22-6

1577-22-6

1577-22-6 Structure

1577-22-6 Structure
IdentificationMore
[Name]

5-HEXENOIC ACID
[CAS]

1577-22-6
[Synonyms]

5-HEXENOIC ACID
RARECHEM AL BO 0638
5-Hexenoic acid, GC 96%
5-HEXENOIC ACID 99%
5-HEXENOIC ACID 98+%
[Molecular Formula]

C6H10O2
[MDL Number]

MFCD00046558
[Molecular Weight]

114.14
[MOL File]

1577-22-6.mol
Chemical PropertiesBack Directory
[Melting point ]

-37°C
[Boiling point ]

105 °C/15 mmHg (lit.)
[density ]

0,961 g/cm3
[refractive index ]

1.4340
[Fp ]

107°C/17mm
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

clear liquid
[pka]

4.76±0.10(Predicted)
[color ]

Colorless to Light yellow
[Specific Gravity]

0.961
[Water Solubility ]

Insoluble in water.
[BRN ]

1743172
[InChI]

InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h2H,1,3-5H2,(H,7,8)
[InChIKey]

XUDOZULIAWNMIU-UHFFFAOYSA-N
[SMILES]

C(O)(=O)CCCC=C
[LogP]

1.256 (est)
[CAS DataBase Reference]

1577-22-6(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314
[Precautionary statements ]

P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
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) .
S27:Take off immediately all contaminated clothing .
[RIDADR ]

3265
[WGK Germany ]

3
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29161900
Hazard InformationBack Directory
[Uses]

5-Hexenoic acid may be used for the preparation of iodolactone derivatives and fluorine-containing δ-valerolactones.
[Uses]

5-Hexenoic acid is used as an organic chemical synthesis intermediate.
[Definition]

ChEBI:Delta-hexenoic acid is a medium-chain fatty acid.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 112, p. 6729, 1990 DOI: 10.1021/ja00174a053
Spectrum DetailBack Directory
[Spectrum Detail]

5-HEXENOIC ACID(1577-22-6)MS
5-HEXENOIC ACID(1577-22-6)1HNMR
5-HEXENOIC ACID(1577-22-6)IR1
5-HEXENOIC ACID(1577-22-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

5-Hexenoic acid, 99%(1577-22-6)
[Sigma Aldrich]

1577-22-6(sigmaaldrich)
[TCI AMERICA]

5-Hexenoic Acid,>98.0%(GC)(T)(1577-22-6)
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