chempirical

4,4′,4′′-Methylidynetrisphenol

C19H16O3CAS 603-44-1292.33 g/mol

Open in Covalent MOL file
OHHOOH
Phenol

Properties

Molecular formula
C19H16O3
Molar mass
292.33 g/mol
Exact mass
292.1099 Da
Melting point
240 °C
logP
3.98Crippen estimate
Polar surface area
60.7 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 11 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number
603-44-1
SMILES
Oc1ccc(C(c2ccc(O)cc2)c2ccc(O)cc2)cc1
InChIKey
WFCQTAXSWSWIHS-UHFFFAOYSA-N
InChI
InChI=1S/C19H16O3/c20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,19-22H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

19 names · show all
  • 4,4',4''-Methylidynetrisphenol
  • 4,4′,4′′-Methylidynetris[phenol]
  • Tris(4-hydroxyphenyl)methane
  • Trisphenol PHBA
  • NSC 75955
  • Phenol, 4,4′,4′′-methylidynetris-
  • Phenol, 4,4′,4′′-methylidynetri-
  • Leucaurin
  • Leucoaurin
  • Tris(p-hydroxyphenyl)methane
  • 4,4′,4′′-Trihydroxytriphenylmethane
  • 4,4′,4′′-Trihydroxyphenylmethane
  • BisP-PHBA
  • BIP-PHBZ
  • AV Lite BIP-PHBZ
  • TrisP-M
  • TrisP-PHBA
  • Tri(4-hydroxyphenyl)methane
  • Tris P-PHBA-S

Work with 4,4′,4′′-Methylidynetrisphenol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Hydroquinone123-31-960 % similar 4-Isopropylphenol99-89-857 % similar 1-(4-Hydroxyphenyl)ethanol2380-91-852 % similar 4-Cyclohexylphenol1131-60-850 % similar 2-(4′-Hydroxyphenyl)-1,3-dithiolane22068-49-150 % similar Hexestrol84-16-250 % similar 4,4′-Dihydroxybiphenyl92-88-650 % similar Octopamine104-14-346 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Coumatetralyl5836-29-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook