4-isothiocyanato-N-(2-oxooxolan-3-yl)benzamide
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4-isothiocyanato-N-(2-oxooxolan-3-yl)benzamide
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CAS No:
58394-58-4
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Formula:
C12H10N2O3S
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Chemical Name:
4-isothiocyanato-N-(2-oxooxolan-3-yl)benzamide
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Synonyms:
4-isothiocyanatobenzoyl-DL-homoserine lactone;p-isothiocyanatobenzoyl-DL-homoserine lactone;para-isothiocyanatobenzoyl-DL-homoserine lactone;4-Isothiocyanatobenzoyl-DL-homoserine lactone;58394-58-4;4-isothiocyanato-N-(2-oxooxolan-3-yl)benzamide;IBHL;p-Isothiocyanatobenzoyl-DL-homoserine lactone;4-isothiocyanato-n-(2-oxotetrahydrofuran-3-yl)benzamide;para-Isothiocyanatobenzoyl-DL-homoserine lactone;SCHEMBL5726185;MFCD00060706;NSC294785;NSC 294785;NSC-294785;FT-0747726;4-Isothiocyanato-N-(2-oxotetrahydro-3-furanyl)benzamide #;4-Isothiocyanatobenzoyl-DL-homoserine lactone, AldrichCPR;Benzamide, 4-isothiocyanato-N-(tetrahydro-2-oxo-3-furanyl)-, (+-)-
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CAS No:
4-isothiocyanato-N-(2-oxooxolan-3-yl)benzamide Basic Attributes
262.29 g/mol
262.04121336 g/mol
294785
Computed Properties
Molecular Weight:262.29
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:262.04121336
Monoisotopic Mass:262.04121336
Topological Polar Surface Area:99.8
Heavy Atom Count:18
Complexity:385
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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