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Phenolphthalein Monophosphate
[CAS# 13306-67-7]

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CAS#: 13306-67-7
Product: Phenolphthalein Monophosphate
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Identification
Name Phenolphthalein Monophosphate
Synonyms (4-Hydroxyphenyl) [4-(3-Oxo-1H-Isobenzofuran-1-Yl)Phenyl] Hydrogen Phosphate; (4-Hydroxyphenyl) [4-(3-Keto-1H-Isobenzofuran-1-Yl)Phenyl] Hydrogen Phosphate; 1(3H)-Isobenzofuranone, 3-(4-Hydroxyphenyl)-3-(4-(Phosphonooxy)Phenyl)-
Molecular Structure CAS#: 13306-67-7, Phenolphthalein Monophosphate
Molecular Formula C20H15O7P
Molecular Weight 398.31
CAS Registry Number 13306-67-7
SMILES C1=CC=CC2=C1C(OC2=O)C3=CC=C(C=C3)O[P](=O)(OC4=CC=C(C=C4)O)O
InChI 1S/C20H15O7P/c21-14-7-11-16(12-8-14)27-28(23,24)26-15-9-5-13(6-10-15)19-17-3-1-2-4-18(17)20(22)25-19/h1-12,19,21H,(H,23,24)
InChIKey ANAZDOWEOOFEET-UHFFFAOYSA-N
Properties
Density 1.496g/cm3 (Cal.)
Boiling point 626.271°C at 760 mmHg (Cal.)
Flash point 332.557°C (Cal.)
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