3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol

C23H24O3 — CID 86006432

IUPAC3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol
SMILESOCCCc1cc(OCc2ccccc2)ccc1OCc1ccccc1
InChIInChI=1S/C23H24O3/c24-15-7-12-21-16-22(25-17-19-8-3-1-4-9-19)13-14-23(21)26-18-20-10-5-2-6-11-20/h1-6,8-11,13-14,16,24H,7,12,15,17-18H2
InChIKeyLUJTUFWADKBOIF-UHFFFAOYSA-N
MW348.44 g/mol
LogP4.77
Rot. Bonds9

About 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol

3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol (PubChem CID 86006432) has the molecular formula C23H24O3 and a molecular weight of 348.44 g/mol. Its IUPAC name is 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol.

Molecular Properties

Compound Name3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol
PubChem CID86006432
Molecular FormulaC23H24O3
Molecular Weight348.44 g/mol
Exact Mass348.17
IUPAC Name3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol
SMILESOCCCc1cc(OCc2ccccc2)ccc1OCc1ccccc1
InChIInChI=1S/C23H24O3/c24-15-7-12-21-16-22(25-17-19-8-3-1-4-9-19)13-14-23(21)26-18-20-10-5-2-6-11-20/h1-6,8-11,13-14,16,24H,7,12,15,17-18H2
InChIKeyLUJTUFWADKBOIF-UHFFFAOYSA-N
XLogP4.77
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.44
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2,5-bis(phenylmethoxy)phenyl]acetic acid
CID 14802088
[3-(3-hydroxypropyl)-4-phenylmethoxyphenyl] 3-methylbenzenesulfonate
CID 54532989
4-[3-[2,5-bis(phenylmethoxy)phenyl]propyl]morpholine
CID 170870322
2-(3-methylbut-2-enyl)-1,4-bis(phenylmethoxy)benzene
CID 11121904
1-[2,5-bis(phenylmethoxy)phenyl]propan-2-amine
CID 170864797
1-[3-[2,4-bis(phenylmethoxy)phenyl]propyl]-2-ethoxy-4-phenylmethoxybenzene
CID 139826646
4-[3,5-bis(phenylmethoxy)phenyl]butan-1-ol
CID 160694879
3-(3-ethoxy-4-phenylmethoxyphenyl)propan-1-ol
CID 170887590
N-(6-hydroxyhexyl)-2,5-bis(phenylmethoxy)benzamide
CID 67718157
4-phenylmethoxy-1-prop-2-enoxy-2-prop-2-enylbenzene
CID 22261130
3-(2-methoxy-5-phenylmethoxyphenyl)propanal
CID 71659859
2,4-dimethoxy-1-[3-[2-[(4-methoxyphenyl)methoxy]-4-phenylmethoxyphenyl]propyl]benzene
CID 139826525

Frequently Asked Questions

What is the IUPAC name of 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol?
The IUPAC name of 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol (CID 86006432) is 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol.
What is the SMILES notation for 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol?
The canonical SMILES for 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol is OCCCc1cc(OCc2ccccc2)ccc1OCc1ccccc1.
What is the InChIKey of 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol?
The InChIKey is LUJTUFWADKBOIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24O3/c24-15-7-12-21-16-22(25-17-19-8-3-1-4-9-19)13-14-23(21)26-18-20-10-5-2-6-11-20/h1-6,8-11,13-14,16,24H,7,12,15,17-18H2.
What are the key properties of 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol?
3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol has a molecular weight of 348.44 g/mol, XLogP of 4.77, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2,5-bis(phenylmethoxy)phenyl]propan-1-ol is sourced from PubChem (CID 86006432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).