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5-nitro-2-phenylsulfanylbenzaldehyde

5-nitro-2-phenylsulfanylbenzaldehyde structure

CAS No:
52548-32-0
Formula:
C13H9NO3S
Chemical Name:
5-nitro-2-phenylsulfanylbenzaldehyde
Synonyms:
5-Nitro-2-(phenylthio)benzaldehyde; 5-nitro-2-phenylsulfanyl-benzaldehyde; 3-nitro-6-(phenylthio)-benzaldehyde; 5-Nitro-2-phenylmercapto-benzaldehyd;

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5-nitro-2-phenylsulfanylbenzaldehyde Basic Attributes

Molecular Weight：

259.28000

Exact Mass：

259.03031432

DSSTox ID：

DTXSID40388071

HScode：

2930909090

Characteristics

PSA：

88.19000

XLogP3：

4.08170

Density：

1.36g/cm3

Melting Point：

106-107ºC

Boiling Point：

413.2ºC at 760 mmHg

Flash Point：

203.7ºC

Refractive Index：

1.666

Safety Information

Marks：

Computed Properties

Molecular Weight:259.28
XLogP3:3.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:259.03031432
Monoisotopic Mass:259.03031432
Topological Polar Surface Area:88.2
Heavy Atom Count:18
Complexity:299
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-nitro-2-phenylsulfanylbenzaldehyde

Basic Attributes
Characteristics
Safety Information
Computed Properties

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