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TETRAIODOPHENOLPHTHALEIN

TETRAIODOPHENOLPHTHALEIN structure

CAS No:
386-17-4
Formula:
C20H10I4O4
Chemical Name:
TETRAIODOPHENOLPHTHALEIN
Synonyms:
3,3-bis(4-hydroxy-3,5-diiodophenyl)phthalide;3',3'',5',5''-TETRAIODOPHENOLPHTHALEIN, INDICATOR GRADE;3,3,5,5-Tetraiodophenolphthaleine;3,3-Bis(4-hydroxy-3,5-diiodophenyl)-1(3H)-isobenzofuranone;3,3-Bis(4-hydroxy-3,5-diiodophenyl)isobenzofuran-1(3H)-one;Iodophene Iodophthalein Tetraiodophthalein;3,3-bis(4-hydroxy-3,5-diiodophenyl)-1(3h)-isobenzofuranon;3’,3’’,5’,5’’-tetraiodo-phenolphthalei
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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TETRAIODOPHENOLPHTHALEIN Basic Attributes

Molecular Weight：

821.91

Exact Mass：

821.91

EC Number：

206-857-9

UNII：

R2CC46UA50

NSC Number：

4904

DSSTox ID：

DTXSID7048291

HScode：

2932.20.4500

Characteristics

PSA：

66.76000

XLogP3：

5.97850

Density：

2.0201

Melting Point：

268 °C (dec.)(lit.)

Boiling Point：

607.5±55.0 °C(Predicted)

Flash Point：

351.8ºC

Refractive Index：

1.874

PKA：

6.37±0.40(Predicted)

Safety Information

wgk germany：

RTECS Number：

SM8397000

Drug Information

MeSH Entry Terms：

iodophthalein

TETRAIODOPHENOLPHTHALEIN Use and Manufacturing

3'',3'''',5'',5''''-Tetraiodophenolphthalein (CAS# 386-17-4) is a derivative of phenolphthalein (P318010), an indicator and dye. 3'',3'''',5'',5''''-Tetraiodophenolphthalein has been explored for use as a prototype drug for group of structurally related calcium channel blockers in human platelets.

Computed Properties

Molecular Weight:821.9
XLogP3:6.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:821.6758
Monoisotopic Mass:821.6758
Topological Polar Surface Area:66.8
Heavy Atom Count:28
Complexity:551
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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TETRAIODOPHENOLPHTHALEIN

CAS No.: 386-17-4

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