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5-nitro-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbenzaldehyde

5-nitro-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbenzaldehyde structure

CAS No:
680579-40-2
Formula:
C13H7F3N2O3S
Chemical Name:
5-nitro-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbenzaldehyde

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5-nitro-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbenzaldehyde Basic Attributes

Molecular Weight：

328.26600

Exact Mass：

328.01294775

DSSTox ID：

DTXSID40381522

Characteristics

PSA：

101.08000

XLogP3：

4.49550

Density：

1.53g/cm3

Boiling Point：

447.4ºC at 760 mmHg

Flash Point：

224.4ºC

Refractive Index：

1.602

Computed Properties

Molecular Weight:328.27
XLogP3:3.4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:328.01294775
Monoisotopic Mass:328.01294775
Topological Polar Surface Area:101
Heavy Atom Count:22
Complexity:416
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-nitro-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbenzaldehyde

Basic Attributes
Characteristics
Computed Properties

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