2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol

C27H24O2 — CID 122540105

IUPAC2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol
SMILESOCCc1cc(-c2ccccc2)ccc1-c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C27H24O2/c28-17-16-25-18-23(22-10-5-2-6-11-22)14-15-27(25)24-12-7-13-26(19-24)29-20-21-8-3-1-4-9-21/h1-15,18-19,28H,16-17,20H2
InChIKeySHMWCKMHYFPSOJ-UHFFFAOYSA-N
MW380.49 g/mol
LogP6.13
Rot. Bonds7

About 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol

2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol (PubChem CID 122540105) has the molecular formula C27H24O2 and a molecular weight of 380.49 g/mol. Its IUPAC name is 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol.

Molecular Properties

Compound Name2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol
PubChem CID122540105
Molecular FormulaC27H24O2
Molecular Weight380.49 g/mol
Exact Mass380.18
IUPAC Name2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol
SMILESOCCc1cc(-c2ccccc2)ccc1-c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C27H24O2/c28-17-16-25-18-23(22-10-5-2-6-11-22)14-15-27(25)24-12-7-13-26(19-24)29-20-21-8-3-1-4-9-21/h1-15,18-19,28H,16-17,20H2
InChIKeySHMWCKMHYFPSOJ-UHFFFAOYSA-N
XLogP6.13
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.49
LogP ≤ 56.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-phenyl-5-phenylmethoxyphenol
CID 123808909
1,3-diphenylbenzene;4-phenylmethoxyphenol
CID 70041760
[3-ethyl-5-(3-phenylmethoxyphenyl)phenyl]methanol
CID 122435033
1-isocyanato-4-(3-phenylmethoxyphenyl)benzene
CID 169354799
2-methyl-5-(3-phenylmethoxyphenyl)phenol
CID 53219180
3-[3-(3-phenylmethoxyphenyl)phenyl]propanoic acid
CID 58239597
[2-(3-phenylmethoxyphenyl)pyrimidin-5-yl]methanol
CID 172877663
2-[2-chloro-4-(3-phenylmethoxyphenyl)phenyl]acetic acid
CID 176516199
3-(3-phenylmethoxyphenyl)-2-propan-2-ylpyridine
CID 71204410
2-[4-methyl-2-(3-phenylmethoxyphenyl)phenyl]ethanamine
CID 164888225
3-[2-(2-aminooxyethyl)-4-phenylphenyl]phenol
CID 134325502
2-methyl-3-(3-phenylmethoxyphenyl)benzoic acid
CID 53228681

Frequently Asked Questions

What is the IUPAC name of 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol?
The IUPAC name of 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol (CID 122540105) is 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol.
What is the SMILES notation for 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol?
The canonical SMILES for 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol is OCCc1cc(-c2ccccc2)ccc1-c1cccc(OCc2ccccc2)c1.
What is the InChIKey of 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol?
The InChIKey is SHMWCKMHYFPSOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24O2/c28-17-16-25-18-23(22-10-5-2-6-11-22)14-15-27(25)24-12-7-13-26(19-24)29-20-21-8-3-1-4-9-21/h1-15,18-19,28H,16-17,20H2.
What are the key properties of 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol?
2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol has a molecular weight of 380.49 g/mol, XLogP of 6.13, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-phenyl-2-(3-phenylmethoxyphenyl)phenyl]ethanol is sourced from PubChem (CID 122540105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).