Vanitrope
CAS No.:
94-86-0
M. Wt:
178.228
M. Fa:
C11H14O2
InChI Key:
RADIRXJQODWKGQ-HWKANZROSA-N
Appearance:
White To Almost White Powder To Crystal
Names and Identifiers of Vanitrope
CAS Number |
94-86-0 |
|---|---|
EC Number |
202-370-0 |
MDL Number |
MFCD00009283 |
IUPAC Name |
2-ethoxy-5-[(E)-prop-1-enyl]phenol |
InChI |
InChI=1S/C11H14O2/c1-3-5-9-6-7-11(13-4-2)10(12)8-9/h3,5-8,12H,4H2,1-2H3/b5-3+ |
InChIKey |
RADIRXJQODWKGQ-HWKANZROSA-N |
Canonical SMILES |
CCOC1=C(C=C(C=C1)C=CC)O |
Isomeric SMILES |
CCOC1=C(C=C(C=C1)/C=C/C)O |
UNII |
JP95W81L3F |
UNSPSC Code |
12352100 |
Physical and chemical properties of Vanitrope
Acidity coefficient |
10.02±0.10(Predicted) |
|---|---|
Boiling Point |
312.00 to 313.00 °C. @ 760.00 mm Hg |
Density |
1.1±0.1 g/cm3 |
Exact Mass |
178.099380 |
Flash Point |
165.2±9.5 °C |
H Bond Acceptors |
2 |
H Bond Donors |
1 |
Index of Refraction |
1.567 |
LogP |
3.415 (est) |
Melting Point |
86 - 88 °C |
Molecular Formula |
C11H14O2 |
Molecular Weight |
178.228 |
PSA |
29.46000 |
Solubility |
soluble (in ethanol) |
Storage condition |
2-8°C |
Vapour Pressure |
0.0±0.7 mmHg at 25°C |
Water Solubility |
Insoluble in water |
Safety Information of Vanitrope
Physical sample testing spectrum (NMR) of Vanitrope
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