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2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylaniline

2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylaniline structure

CAS No:
322-71-4
Formula:
C13H9F3N2O2S
Chemical Name:
2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylaniline
Synonyms:
322-71-4;2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylaniline;MLS000859039;SMR000459218;2-{[2-nitro-4-(trifluoromethyl)phenyl]thio}aniline;2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]aniline;NSC403051;Maybridge1_004113;cid_345425;CHEMBL1585551;BDBM78342;HMS553C23;DTXSID50323110;Benzenamine, 2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-;HMS2810B22;ZINC164835;MFCD00277378;MCULE-6410481708;NSC-403051;2'-Amino-2-nitro-4-trifluoromethyldiphenylsulfide;2-Amino-2'-nitro-4'-(trifluoromethyl)diphenyl sulphide;[2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]phenyl]amine;2-([2-Nitro-4-(trifluoromethyl)phenyl]sulfanyl)aniline #

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2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylaniline Basic Attributes

Molecular Weight：

314.28 g/mol

Exact Mass：

314.03368319 g/mol

NSC Number：

403051

DSSTox ID：

DTXSID50323110

Characteristics

PSA：

97.1 Å²

Water Solubility：

5.6 [ug/mL]

Computed Properties

Molecular Weight:314.28
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:314.03368319
Monoisotopic Mass:314.03368319
Topological Polar Surface Area:97.1
Heavy Atom Count:21
Complexity:375
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylaniline

Basic Attributes
Characteristics
Computed Properties

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