26782-75-2

Name (S)-(-)-2-Bromo-3-methylbutyric acid
CAS 26782-75-2
Molecular Formula C5H9BrO2
MDL Number MFCD00210114
Molecular Weight 181.03
MOL File 26782-75-2.mol
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Chemical Properties

Melting point  39-44 °C
alpha  -21 º (c=37 in benzene)
Boiling point  90-100 °C (0.5 mmHg)
density  1.4210 (rough estimate)
refractive index  1.4790 (estimate)
Fp  >110 °C
form  solid
pka 3.00±0.10(Predicted)
Optical Rotation [α]22/D 21°, c = 37 in benzene
InChI 1S/C5H9BrO2/c1-3(2)4(6)5(7)8/h3-4H,1-2H3,(H,7,8)/t4-/m0/s1
InChIKey UEBARDWJXBGYEJ-BYPYZUCNSA-N
SMILES CC(C)[C@H](Br)C(O)=O
CAS DataBase Reference 26782-75-2(CAS DataBase Reference)

Safety Data

Hazard Codes  C
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R34:Causes burns.
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 .
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
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
WGK Germany  3
HazardClass  8
Storage Class 8A - Combustible corrosive hazardous materials
Hazard Classifications Acute Tox. 4 Oral
Eye Dam. 1
Skin Corr. 1B

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