4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol

C38H30O3 — CID 91006849

IUPAC4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol
SMILESOc1ccc(C(OC(c2ccccc2)(c2ccccc2)c2ccc(O)cc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C38H30O3/c39-35-25-21-33(22-26-35)37(29-13-5-1-6-14-29,30-15-7-2-8-16-30)41-38(31-17-9-3-10-18-31,32-19-11-4-12-20-32)34-23-27-36(40)28-24-34/h1-28,39-40H
InChIKeyMWNVKMVHNVDPGE-UHFFFAOYSA-N
MW534.66 g/mol
LogP8.40
Rot. Bonds8

About 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol

4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol (PubChem CID 91006849) has the molecular formula C38H30O3 and a molecular weight of 534.66 g/mol. Its IUPAC name is 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol.

Molecular Properties

Compound Name4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol
PubChem CID91006849
Molecular FormulaC38H30O3
Molecular Weight534.66 g/mol
Exact Mass534.22
IUPAC Name4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol
SMILESOc1ccc(C(OC(c2ccccc2)(c2ccccc2)c2ccc(O)cc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C38H30O3/c39-35-25-21-33(22-26-35)37(29-13-5-1-6-14-29,30-15-7-2-8-16-30)41-38(31-17-9-3-10-18-31,32-19-11-4-12-20-32)34-23-27-36(40)28-24-34/h1-28,39-40H
InChIKeyMWNVKMVHNVDPGE-UHFFFAOYSA-N
XLogP8.40
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500534.66
LogP ≤ 58.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

4-Methoxy-alpha,alpha-diphenylbenzenemethanol
CID 70061
Phenol, 4,4',4'',4'''-(1,2-ethanediylidene)tetrakis-
CID 82180
1,3,5-Tris(4-hydroxyphenyl)benzene
CID 348148
4,4',4''-Methylidynetrisphenol
CID 69047
Anolignan C
CID 454714
Gastrol
CID 636636
Bis(4-hydroxyphenyl)diphenylmethane
CID 232881
(4-Hydroxyphenyl)diphenylmethanol
CID 263208
4-Tritylphenol
CID 70422
(+)-Larreatricin
CID 14213223
4-(2-Oxabicyclo[2.2.2]octan-1-yl)phenol
CID 135348923
Blepharocalyxin D
CID 9985898

Frequently Asked Questions

What is the IUPAC name of 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol?
The IUPAC name of 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol (CID 91006849) is 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol.
What is the SMILES notation for 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol?
The canonical SMILES for 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol is Oc1ccc(C(OC(c2ccccc2)(c2ccccc2)c2ccc(O)cc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol?
The InChIKey is MWNVKMVHNVDPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H30O3/c39-35-25-21-33(22-26-35)37(29-13-5-1-6-14-29,30-15-7-2-8-16-30)41-38(31-17-9-3-10-18-31,32-19-11-4-12-20-32)34-23-27-36(40)28-24-34/h1-28,39-40H.
What are the key properties of 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol?
4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol has a molecular weight of 534.66 g/mol, XLogP of 8.40, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(4-hydroxyphenyl)-diphenylmethoxy]-diphenylmethyl]phenol is sourced from PubChem (CID 91006849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).