3-[(6,7-Dimethoxy-4-Quinazolinyl)Amino]Phenol

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Properties Simple | Detailed

Formula C16H16N3O3
IUPAC Name 3-[(6,7-dimethoxyquinazoline-1,3-diium-4a-id-4-yl)amino]phenol
Molecular Mass 298.317 g·mol−1
Heat of Formation -145.3 ± 16.7 kJ·mol−1
Dipole Moment 5.12 ± 1.08 D
Volume 337.59 Å 3
Surface Area 313.61 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 1.93 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(3′-hydroxyphenyl)amino-6,7-dimethoxyquinazoline, hcl
  • 4-[3-hydroxyanilino]-6,7-dimethoxyquinazoline
  • dtq
  • k00036
  • whi-p180, hydrochloride
  • whi-p180; 4-(3'-hydroxyphenyl)amino-6,7-dimethoxyquinazoline, hcl
InChIKey BNDYIYYKEIXHNK-UHFFFAOYSA-N
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