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24-1450

Sigma-Aldrich

Phenolphthalein

SAJ first grade, ≥97.0%

Synonym(s):

3,3-Bis(4-hydroxyphenyl)-1(3H)-isobenzofuranone

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About This Item

Empirical Formula (Hill Notation):
C20H14O4
CAS Number:
77-09-8
Molecular Weight:
318.32
Colour Index Number:
764
Beilstein:
284423
EC Number:
201-004-7
MDL number:
MFCD00005913
UNSPSC Code:
12352005
PubChem Substance ID:
329752586

grade

SAJ first grade

Assay

≥97.0%

form

solid

availability

available only in Japan

mp

261-263 °C (lit.)

solubility

acetone: soluble

SMILES string

Oc1ccc(cc1)C2(OC(=O)c3ccccc23)c4ccc(O)cc4

InChI

1S/C20H14O4/c21-15-9-5-13(6-10-15)20(14-7-11-16(22)12-8-14)18-4-2-1-3-17(18)19(23)24-20/h1-12,21-22H

InChI key

KJFMBFZCATUALV-UHFFFAOYSA-N

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Pictograms

Health hazardExclamation mark
GHS08,GHS07

Signal Word

Danger

Hazard Statements

H315,H341,H350,H361f

Hazard Classifications

Carc. 1B - Muta. 2 - Repr. 2 - Skin Irrit. 2

Storage Class Code

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Journal of medicinal chemistry, 54(15), 5454-5467 (2011-06-24)
To identify specific bacterial thymidylate synthase (TS) inhibitors, we exploited phenolphthalein (PTH), which inhibits both bacterial and human enzymes. The X-ray crystal structure of Lactobacillus casei TS (LcTS) that binds PTH showed multiple binding modes of the inhibitor, which prevented
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