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3-nitro-5-phenylsulfanylaniline

3-nitro-5-phenylsulfanylaniline structure

CAS No:
208038-89-5
Formula:
C12H10N2O2S
Chemical Name:
3-nitro-5-phenylsulfanylaniline
Synonyms:
3-nitro-5-phenylthiophenylamine;

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3-nitro-5-phenylsulfanylaniline Basic Attributes

Molecular Weight：

246.28500

Exact Mass：

246.04629874 g/mol

DSSTox ID：

DTXSID00351443

Characteristics

PSA：

97.14000

XLogP3：

4.43260

Density：

1.37g/cm3

Boiling Point：

464.1ºC at 760 mmHg

Flash Point：

234.5ºC

Refractive Index：

1.696

Vapor Pressure：

8.61E-09mmHg at 25°C

Computed Properties

Molecular Weight:246.29
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:246.04629874
Monoisotopic Mass:246.04629874
Topological Polar Surface Area:97.1
Heavy Atom Count:17
Complexity:264
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-nitro-5-phenylsulfanylaniline

Basic Attributes
Characteristics
Computed Properties

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