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4',4''''-(5-METHYL-1,3-PHENYLENE)BIS-2,2':6',2''-TERPYRIDINE

4',4''''-(5-METHYL-1,3-PHENYLENE)BIS-2,2':6',2''-TERPYRIDINE structure

CAS No:
258834-70-7
Formula:
C37H26N6
Chemical Name:
4',4''''-(5-METHYL-1,3-PHENYLENE)BIS-2,2':6',2''-TERPYRIDINE
Synonyms:
7-methyl-1,3,5-triazatricyclo[3.3.1.13,7]decane; 1-methyl-3,5-bis(2,2':6',2''-terpyridin-4'yl)benzene; 1,3-bis(2,2':6',2''-terpyridin-4'-yl)-5-methylbenzene; 1-Methyl-3,5,7-triazatricyclo<3.3.1.13.7>decan; 1,3,5-Triazatricyclo(3.3.1.13,7)decane,7-methyl;

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4',4''''-(5-METHYL-1,3-PHENYLENE)BIS-2,2':6',2''-TERPYRIDINE Basic Attributes

Molecular Weight：

554.64300

Exact Mass：

554.22189485

Characteristics

PSA：

77.34000

XLogP3：

8.36700

Density：

1.214g/cm3

Boiling Point：

709.5ºC

Flash Point：

385.4ºC

Refractive Index：

1.652

Vapor Pressure：

3.68E-19mmHg at 25°C

Computed Properties

Molecular Weight:554.6
XLogP3:5.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:554.22189485
Monoisotopic Mass:554.22189485
Topological Polar Surface Area:77.3
Heavy Atom Count:43
Complexity:787
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4',4''''-(5-METHYL-1,3-PHENYLENE)BIS-2,2':6',2''-TERPYRIDINE

Basic Attributes
Characteristics
Computed Properties

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