Phentolamine

CAS Registry Number®

50-60-2
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CAS Name

Phentolamine

Molecular Formula

C17H19N3O

Molecular Mass

281.35

Cite this Page

Phentolamine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=50-60-2 (retrieved 2024-05-20) (CAS RN: 50-60-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    174-175 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C17H19N3O/c1-13-5-7-14(8-6-13)20(12-17-18-9-10-19-17)15-3-2-4-16(21)11-15/h2-8,11,21H,9-10,12H2,1H3,(H,18,19)

InChIKey

InChIKey=MRBDMNSDAVCSSF-UHFFFAOYSA-N

SMILES

N(CC=1NCCN1)(C2=CC(O)=CC=C2)C3=CC=C(C)C=C3

Canonical SMILES

OC1=CC=CC(=C1)N(C2=CC=C(C=C2)C)CC3=NCCN3

Other Names for this Substance

  • Phenol, 3-[[(4,5-dihydro-1H-imidazol-2-yl)methyl](4-methylphenyl)amino]-
  • Phenol, m-[N-(2-imidazolin-2-ylmethyl)-p-toluidino]-
  • 3-[[(4,5-Dihydro-1H-imidazol-2-yl)methyl](4-methylphenyl)amino]phenol
  • C 7337 Ciba
  • 2-[[N-(m-Hydroxyphenyl)-p-toluidino]methyl]-2-imidazoline

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