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161186-49-8

161186-49-8 structure

CAS No:
161186-49-8
Formula:
C44H52ClN7O6
Chemical Name:
161186-49-8

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161186-49-8 Basic Attributes

Molecular Weight：

810.38000

Exact Mass：

809.3667601 g/mol

DSSTox ID：

DTXSID50167076

Characteristics

PSA：

200.53000

XLogP3：

8.28730

Density：

1.262g/cm3

Boiling Point：

1102.2ºC

Flash Point：

620.4ºC

Refractive Index：

1.616

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:810.4
XLogP3:6.4
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:20
Exact Mass:809.3667601
Monoisotopic Mass:809.3667601
Topological Polar Surface Area:187
Heavy Atom Count:58
Complexity:1290
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 161186-49-8

Basic Attributes
Characteristics
Computed Properties

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