2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

CAS Registry Number®

58632-95-4

CAS Name

2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

Molecular Formula

C13H14N2O3

Molecular Mass

246.26

Cite this Page

2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=58632-95-4 (retrieved 2024-12-18) (CAS RN: 58632-95-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    82-84 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H14N2O3/c1-13(2,3)17-12(16)18-15-11(9-14)10-7-5-4-6-8-10/h4-8H,1-3H3

InChIKey

InChIKey=QQWYQAQQADNEIC-UHFFFAOYSA-N

SMILES

C(=NOC(OC(C)(C)C)=O)(C#N)C1=CC=CC=C1

Canonical SMILES

N#CC(=NOC(=O)OC(C)(C)C)C=1C=CC=CC1

Other Names for this Substance

  • Carbonic acid, (cyanophenylmethylene)azanyl 1,1-dimethylethyl ester
  • Benzeneacetonitrile, α-[[[(1,1-dimethylethoxy)carbonyl]oxy]imino]-
  • 2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile
  • 2-(tert-Butyloxycarbonyloxyimino)-2-phenylacetonitrile
  • Boc-ON

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Deleted or Replaced CAS Registry Numbers

103919-55-7, 115721-57-8, 154920-47-5

CAS INSIGHTSTM
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