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Temozolomide

CAS Registry Number®

85622-93-1

CAS Name

Temozolomide

Molecular Formula

C6H6N6O2

Molecular Mass

194.15

Cite this Page

Temozolomide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=85622-93-1 (retrieved 2024-11-23) (CAS RN: 85622-93-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    212 °C (decomp)

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C6H6N6O2/c1-11-6(14)12-2-8-3(4(7)13)5(12)9-10-11/h2H,1H3,(H2,7,13)

InChIKey

InChIKey=BPEGJWRSRHCHSN-UHFFFAOYSA-N

SMILES

C(N)(=O)C1=C2N(C(=O)N(C)N=N2)C=N1

Canonical SMILES

O=C(N)C=1N=CN2C(=O)N(N=NC12)C

Other Names for this Substance

  • Imidazo[5,1-d]-1,2,3,5-tetrazine-8-carboxamide, 3,4-dihydro-3-methyl-4-oxo-
  • 3,4-Dihydro-3-methyl-4-oxoimidazo[5,1-d]-1,2,3,5-tetrazine-8-carboxamide
  • CCRG 81045
  • NSC 362856
  • M and B 39831

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Deleted or Replaced CAS Registry Numbers

97716-75-1

CAS INSIGHTSTM
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