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ChemicalBook--->CAS DataBase List--->1730-91-2

1730-91-2

1730-91-2 Structure

1730-91-2 Structure
IdentificationMore
[Name]

(S)-(+)-2-Methylbutyric acid
[CAS]

1730-91-2
[Synonyms]

RARECHEM AL BO 1316
(S)-(+)-2-METHYLBUTYRIC ACID
Butanoic acid, 2-methyl-, (2S)-
(S)-(+)-2-Methylbutyric acid 98%
[Molecular Formula]

C5H10O2
[MDL Number]

MFCD00063166
[Molecular Weight]

102.13
[MOL File]

1730-91-2.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless liquid
[Melting point ]

-55°C
[alpha ]

19 º (c=neat)
[Boiling point ]

78 °C/15 mmHg (lit.)
[density ]

0.938 g/mL at 25 °C(lit.)
[FEMA ]

2695
[refractive index ]

n20/D 1.406(lit.)
[Fp ]

165 °F
[storage temp. ]

2-8°C
[solubility ]

Chloroform (Sparingly), Methanol (Sparingly)
[form ]

Liquid
[pka]

4.80±0.10(Predicted)
[color ]

Clear colorless
[Odor]

fruity sweet
[optical activity]

[α]20/D +19°, neat
[BRN ]

1720485
[Stability:]

Hygroscopic
[InChIKey]

WLAMNBDJUVNPJU-BYPYZUCNSA-N
[LogP]

1.051 (est)
[CAS DataBase Reference]

1730-91-2(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
R21/22:Harmful 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 .
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 3265 8/PG 2
[WGK Germany ]

3
[F ]

13
[HS Code ]

29159000
Raw materials And Preparation ProductsBack Directory
[Raw materials]

2-ETHYLACRYLIC ACID 98-->Decanoic acid-->trans-Cinnamic acid-->Tiglic acid
[Preparation Products]

(S)-(-)-2-Methyl-1-butanol-->(R)-2-Methylbutyric acid-->2,3-DIMETHYL-2-PENTENE-->BENZYL TIGLATE-->Lauric acid-->(S)-2-Methylbutanoyl chloride
Hazard InformationBack Directory
[Chemical Properties]

clear colorless liquid
[Uses]

(S)-(+)-2-Methylbutyric Acid is a chiral starting reagent used in various synthetic preparations.
[Uses]

(S)-(+)-2-Methylbutyric acid may be used in the preparation of the stereoisomers of (R)-lavandulyl (S)-2-methylbutanoate and (R)-maconelliyl (S)-2-methylbutanoate, which are female sex pheromones found in pink hibiscus mealybug.
[Definition]

ChEBI: The (S)-enantiomer of 2-methylbutanoic acid.
[Purification Methods]

Purify the acid by distilling it in vacuo [Sax & Bergmann J Am Chem Soc 77 1910 1955, Doering & Aschner J Am Chem Soc 75 393 1953 ]. The methyl ester is formed by addition of diazomethane and has b 112-115o/760mm, [] D +21.1o (c 1.7, MeOH). [Beilstein 2 IV 888.]
Spectrum DetailBack Directory
[Spectrum Detail]

(S)-(+)-2-Methylbutyric acid(1730-91-2)1HNMR
(S)-(+)-2-Methylbutyric acid(1730-91-2)FT-IR
(S)-(+)-2-Methylbutyric acid(1730-91-2)Raman
(S)-(+)-2-Methylbutyric acid(1730-91-2)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

(S)-(+)-2-Methylbutyric acid, 98%(1730-91-2)
[Alfa Aesar]

(S)-(+)-2-Methylbutyric acid, 98%(1730-91-2)
[Sigma Aldrich]

1730-91-2(sigmaaldrich)
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