590-92-1

Name 3-Bromopropionic acid
CAS 590-92-1
EINECS(EC#) 209-694-1
Molecular Formula C3H5BrO2
MDL Number MFCD00002763
Molecular Weight 152.97
MOL File 590-92-1.mol
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Chemical Properties

Appearance white to pale yellow or orange crystalline
Melting point  58-62 °C(lit.)
Boiling point  140-142 °C (45 mmHg)
density  1.48 g/mL at 25 °C(lit.)
refractive index  1.4753 (estimate)
Fp  150 °F
storage temp.  2-8°C
solubility  H2O: 0.1 g/mL, clear
form  Crystals or Crystalline Powder
pka 4.00(at 25℃)
color  White to slightly yellow
Water Solubility  0.1 g/mL
Detection Methods T,NMR
Merck  14,1433
BRN  1071333
Dielectric constant 11.0（20℃）
InChI 1S/C3H5BrO2/c4-2-1-3(5)6/h1-2H2,(H,5,6)
InChIKey DHXNZYCXMFBMHE-UHFFFAOYSA-N
SMILES OC(=O)CCBr
CAS DataBase Reference 590-92-1(CAS DataBase Reference)
NIST Chemistry Reference Propanoic acid, 3-bromo-(590-92-1)
EPA Substance Registry System 590-92-1(EPA Substance)
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Safety Data

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  F,C
Risk Statements 
R11:Highly Flammable.
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) .
RIDADR  UN 3261 8/PG 2
WGK Germany  3
RTECS  UE7875000
Hazard Note  Corrosive/Highly Flammable
TSCA  Yes
HazardClass  4.1
PackingGroup  III
HS Code  29159080
Storage Class 8A - Combustible corrosive hazardous materials
Hazard Classifications Eye Dam. 1
Skin Corr. 1B
Safety Profile
Moderately toxic by intraperitoneal route. Questionable carcinogen with experimental tumorigenic data. Mutation data reported. When heated to decomposition it emits toxic fumes of Br-. See also BROMIDES.
Hazardous Substances Data 590-92-1(Hazardous Substances Data)

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Material Safety Data Sheet(MSDS)

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