27115-50-0

Name 4-METHYLHIPPURIC ACID
CAS 27115-50-0
EINECS(EC#) 248-231-8
Molecular Formula C10H11NO3
MDL Number MFCD00020449
Molecular Weight 193.2
MOL File 27115-50-0.mol
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Chemical Properties

Appearance WHITE CRYSTALLINE POWDER
Melting point  163-165 °C (lit.)
Boiling point  329.41°C (rough estimate)
density  1.2307 (rough estimate)
refractive index  1.5300 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 3.72±0.10(Predicted)
color  White to Off-White
InChI 1S/C10H11NO3/c1-7-2-4-8(5-3-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)
InChIKey NRSCPTLHWVWLLH-UHFFFAOYSA-N
SMILES Cc1ccc(cc1)C(=O)NCC(O)=O
CAS DataBase Reference 27115-50-0(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
WGK Germany  3
HS Code  2924297099
Storage Class 11 - Combustible Solids

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