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Home > Encyclopedia > 2-(TERT-BUTOXYCARBONYL)PHENYLISOTHIOCYANATE

2-(TERT-BUTOXYCARBONYL)PHENYLISOTHIOCYANATE

2-(TERT-BUTOXYCARBONYL)PHENYLISOTHIOCYANATE structure

2-(TERT-BUTOXYCARBONYL)PHENYLISOTHIOCYANATE 

structure
  • CAS No:

    890091-28-8

  • Formula:

    C12H13NO2S

  • Chemical Name:

    2-(TERT-BUTOXYCARBONYL)PHENYLISOTHIOCYANATE

  • Synonyms:

    2-(TERT-BUTOXYCARBONYL)PHENYL ISOTHIOCYANATE;TERT-BUTYL 2-ISOTHIOCYANATOBENZOATE;Benzoic acid, 2-isothiocyanato-, 1,1-dimethylethyl ester

2-(TERT-BUTOXYCARBONYL)PHENYLISOTHIOCYANATE Basic Attributes

235.3

235.06669983

DTXSID70401469

Characteristics

43-46 °C

Safety Information

3

20/21/22-42

22-36/37-45

Xn

Computed Properties

Molecular Weight:235.30
XLogP3:4.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:235.06669983
Monoisotopic Mass:235.06669983
Topological Polar Surface Area:70.8
Heavy Atom Count:16
Complexity:303
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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