3-(3-nitro-4-pyridin-2-ylsulfanylphenyl)prop-2-enoic acid
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3-(3-nitro-4-pyridin-2-ylsulfanylphenyl)prop-2-enoic acid
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CAS No:
175278-56-5
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Formula:
C14H10N2O4S
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Chemical Name:
3-(3-nitro-4-pyridin-2-ylsulfanylphenyl)prop-2-enoic acid
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Synonyms:
3-Nitro-4-(pyridin-2-ylthio)cinammic acid; 2-Propenoic acid,3-[3-nitro-4-(2-pyridinylthio)phenyl]; (2E)-3-[3-nitro-4-(pyridin-2-ylsulfanyl)phenyl]prop-2-enoic acid;
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CAS No:
3-(3-nitro-4-pyridin-2-ylsulfanylphenyl)prop-2-enoic acid Basic Attributes
302.30500
302.03612798
DTXSID80384299
2933399090
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:302.31
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:302.03612798
Monoisotopic Mass:302.03612798
Topological Polar Surface Area:121
Heavy Atom Count:21
Complexity:410
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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