4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid
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4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid
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CAS No:
27816-59-7
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Formula:
C17H14N2O7S3
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Chemical Name:
4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid
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Synonyms:
Benzenesulfonic acid,5-(acetylamino)-2-[2-(4-isothiocyanato-2-sulfophenyl)ethenyl]-;2,2′-Stilbenedisulfonic acid,4-acetamido-4′-isothiocyanato-;5-(Acetylamino)-2-[2-(4-isothiocyanato-2-sulfophenyl)ethenyl]benzenesulfonic acid;4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid;4-Acetamido-4′-isothiocyanostilbene-2,2′-disulfonic acid;4-Acetamido-4′-isothiocyano-2,2′-stilbene disulfonate;4-Acetamido-4′-isothiocyanate-stilbene-2,2′-disulfonic acid;4-Acetamido-4′-isothiocyano-2,2′-disulfonic stilbene;4-Acetamido-4′-isothiocyano-2,2′-disulfonic acid stilbene;NSC 328387;NSC 649691
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CAS No:
4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid Basic Attributes
454.486
454.50
256-919-4
Safety Information
P261, P264, P270, P271, P280, P285, P301+P312, P302+P352, P304+P340, P304+P341, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P342+P311, P362, P403+P233, P405, P501
H302
Computed Properties
Molecular Weight:454.5
XLogP3:2.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:453.99631431
Monoisotopic Mass:453.99631431
Topological Polar Surface Area:199
Heavy Atom Count:29
Complexity:883
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid
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