4-(butylamino)-3-nitrothiochromen-2-one
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4-(butylamino)-3-nitrothiochromen-2-one
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CAS No:
59647-29-9
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Formula:
C13H14N2O3S
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Chemical Name:
4-(butylamino)-3-nitrothiochromen-2-one
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Synonyms:
3-Nitro-4-n-butylamino-thiocumarin; 1-Thiocoumarin,4-butylamino-3-nitro; 4-Butylamino-3-nitro-1-thiocoumarin; 4-butylamino-3-nitro-thiochromen-2-one;
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CAS No:
4-(butylamino)-3-nitrothiochromen-2-one Basic Attributes
278.32700
278.07251349
DTXSID10208313
2932209090
Computed Properties
Molecular Weight:278.33
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:278.07251349
Monoisotopic Mass:278.07251349
Topological Polar Surface Area:100
Heavy Atom Count:19
Complexity:403
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-(butylamino)-3-nitrothiochromen-2-one
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