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161186-52-3

161186-52-3 structure

CAS No:
161186-52-3
Formula:
C45H54ClN7O6
Chemical Name:
161186-52-3

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161186-52-3 Basic Attributes

Molecular Weight：

824.40700

Exact Mass：

823.3824102 g/mol

DSSTox ID：

DTXSID30167079

Characteristics

PSA：

200.53000

XLogP3：

8.67740

Density：

1.253g/cm3

Boiling Point：

1105ºC

Flash Point：

619.3ºC

Refractive Index：

1.613

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:824.4
XLogP3:6.8
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:20
Exact Mass:823.3824102
Monoisotopic Mass:823.3824102
Topological Polar Surface Area:187
Heavy Atom Count:59
Complexity:1330
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 161186-52-3

Basic Attributes
Characteristics
Computed Properties

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