Triapenthenol

CAS Registry Number®

76608-88-3
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CAS Name

Triapenthenol

Molecular Formula

C15H25N3O

Molecular Mass

263.38

Cite this Page

Triapenthenol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=76608-88-3 (retrieved 2024-08-28) (CAS RN: 76608-88-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    132-134 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1/C15H25N3O/c1-15(2,3)14(19)13(18-11-16-10-17-18)9-12-7-5-4-6-8-12/h9-12,14,19H,4-8H2,1-3H3/b13-9+

InChIKey

InChIKey=CNFMJLVJDNGPHR-UKTHLTGXNA-N

SMILES

C(\C(C(C)(C)C)O)(=C\C1CCCCC1)/N2C=NC=N2

Canonical SMILES

OC(C(=CC1CCCCC1)N2N=CN=C2)C(C)(C)C

Other Names for this Substance

  • 1H-1,2,4-Triazole-1-ethanol, β-(cyclohexylmethylene)-α-(1,1-dimethylethyl)-, (βE)-
  • 1H-1,2,4-Triazole-1-ethanol, β-(cyclohexylmethylene)-α-(1,1-dimethylethyl)-, (E)-
  • (βE)-β-(Cyclohexylmethylene)-α-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol
  • NTN 811
  • RSW 0411

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Deleted or Replaced CAS Registry Numbers

95660-48-3, 93851-03-7