Benzoic acid, 2-isothiocyanato-5-nitro- (9CI)
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Benzoic acid, 2-isothiocyanato-5-nitro- (9CI)
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CAS No:
392312-73-1
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Formula:
C8H4N2O4S
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Chemical Name:
Benzoic acid, 2-isothiocyanato-5-nitro- (9CI)
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Synonyms:
2-isothiocyanato-5-nitrobenzoic acid;CTK8I5630;ZINC16385737;AKOS024375427;MCULE-9444981249;ST51016121
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CAS No:
Computed Properties
Molecular Weight:224.20
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:223.98917779
Monoisotopic Mass:223.98917779
Topological Polar Surface Area:128
Heavy Atom Count:15
Complexity:321
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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