62893-24-7

Name (2R)-2-[(4-Ethyl-2,3-dioxopiperazinyl)carbonylamino]-2-(4-hydroxyphenyl)acetic acid
CAS 62893-24-7
EINECS(EC#) 279-328-3
Molecular Formula C15H17N3O6
MDL Number MFCD00792472
Molecular Weight 335.31
MOL File 62893-24-7.mol

Chemical Properties

Appearance white crystalline powder
Melting point  205 °C (dec.) (lit.)
alpha  -0.85 º(c=1,MeOH)
Boiling point  471.96°C (rough estimate)
density  1.2546 (rough estimate)
refractive index  1.5600 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  DMSO (Slightly), Methanol (Sparingly)
form  Solid
pka 3.40±0.10(Predicted)
color  White to Off-White
Optical Rotation [α]20/D 85°, c = 1 in methanol
InChI InChI=1/C15H17N3O6/c1-2-17-7-8-18(13(21)12(17)20)15(24)16-11(14(22)23)9-3-5-10(19)6-4-9/h3-6,11,19H,2,7-8H2,1H3,(H,16,24)(H,22,23)/t11-/s3
InChIKey IPARGUVYMOMVNU-LBPXTSNRNA-N
SMILES C(N1CCN(CC)C(=O)C1=O)(=O)N[C@H](C1C=CC(O)=CC=1)C(=O)O |&1:13,r|
CAS DataBase Reference 62893-24-7(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
WGK Germany  3
HS Code  2933.59.8000
REACH Registrations Inactive
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Hazard Information

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