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4,4',4'',4'''-(1,9-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoicacid

4,4',4'',4'''-(1,9-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoicacid structure

CAS No:
933047-52-0
Formula:
C44H26O8
Chemical Name:
4,4',4'',4'''-(1,9-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoicacid
Synonyms:
4,4',4'',4'''-(1,9-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoic acid;1,3,6,8-Tetra(4-carboxylphenyl) pyrene;[4,4',4'',4'''-(1,9-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoic acidayl)tetrakis-];4,4',4'',4'''-(3a,8a-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoic acid;,4',4'',4'''-(1,9-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoic acid;4,4',4'',4'''-(1,3,6,8-Pyrenetetrayl)tetrabenzoic acid;1,3,6,8-Tetrakis[p-benzoic acid]pyrene;1,3,6,8-Tetra(4'-carboxyphenyl)pyrene
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Pharmaceutical Intermediates > Bulk Drug Intermediates

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4,4',4'',4'''-(1,9-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoicacid Basic Attributes

Molecular Weight：

682.67

Exact Mass：

682.163

Characteristics

PSA：

149.2

XLogP3：

10.0448

Density：

1.442±0.06 g/cm3

Boiling Point：

916.3±65.0 °C(Predicted)

PKA：

3.48±0.10

Safety Information

hazard class code：

36/38-50/53

safety instructions：

26-61

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:682.7
XLogP3:9.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:682.16276778
Monoisotopic Mass:682.16276778
Topological Polar Surface Area:149
Heavy Atom Count:52
Complexity:1120
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1,3,6,8-tetrakis(p-benzoic acid)pyrene

CAS No.: 933047-52-0

Content: 99.00%

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4,4',4'',4'''-(1,9-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoic acid

CAS No.: 933047-52-0

Grade: Industrial Grade

Content: 99%

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Guide of 4,4',4'',4'''-(1,9-dihydropyrene-1,3,6,8-tetrayl)tetrabenzoicacid

Basic Attributes
Characteristics
Safety Information
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