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90-26-6

Name 2-PHENYLBUTYRAMIDE
CAS 90-26-6
EINECS(EC#) 201-980-4
Molecular Formula C10H13NO
MDL Number MFCD00025511
Molecular Weight 163.22
MOL File 90-26-6.mol
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Chemical Properties

Appearance white crystalline powder or needles
Melting point  83-87 °C
Boiling point  290.31°C (rough estimate)
density  1.0508 (rough estimate)
refractive index  1.5718 (estimate)
storage temp.  Refrigerator
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Crystalline Powder or Needles
pka 16.28±0.50(Predicted)
color  White
Major Application pharmaceutical (small molecule)
InChI 1S/C10H13NO/c1-2-9(10(11)12)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H2,11,12)
InChIKey UNFGQCCHVMMMRF-UHFFFAOYSA-N
SMILES NC(=O)C(CC)c1ccccc1
CAS DataBase Reference 90-26-6(CAS DataBase Reference)

Safety Data

Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S24/25:Avoid contact with skin and eyes .
WGK Germany  WGK 3
RTECS  ES4955000
HS Code  29242998
Storage Class 11 - Combustible Solids
Toxicity
LD orl-rat: >500 mg/kg NCNSA6 5,9,1953

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