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4530-20-5

Name BOC-Glycine
CAS 4530-20-5
EINECS(EC#) 224-864-5
Molecular Formula C7H13NO4
MDL Number MFCD00002690
Molecular Weight 175.18
MOL File 4530-20-5.mol
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Chemical Properties

Appearance White To Off-White Powder
Melting point  86-89 °C(lit.)
Boiling point  306.47°C (rough estimate)
density  1.2843 (rough estimate)
refractive index  1.4353 (estimate)
storage temp.  -20°C
solubility  Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
form  Powder
pka 4.00±0.10(Predicted)
color  White to off-white
Water Solubility  soluble
Detection Methods T,NMR
BRN  1101514
InChI InChI=1S/C7H13NO4/c1-7(2,3)12-6(11)8-4-5(9)10/h4H2,1-3H3,(H,8,11)(H,9,10)
InChIKey VRPJIFMKZZEXLR-UHFFFAOYSA-N
SMILES C(O)(=O)CNC(OC(C)(C)C)=O
CAS DataBase Reference 4530-20-5(CAS DataBase Reference)
EPA Substance Registry System 4530-20-5(EPA Substance)

Safety Data

Hazard Codes  Xn,Xi
Risk Statements 
R22:Harmful if swallowed.
R41:Risk of serious damage to eyes.
R36/37/38:Irritating to eyes, respiratory system and skin .
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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S39:Wear eye/face protection .
S36:Wear suitable protective clothing .
RIDADR  UN 2811 6.1/PG 3
WGK Germany  3
TSCA  Yes
HS Code  29241990

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