1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol

C22H22O2 — CID 18927881

IUPAC1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol
SMILESCC(O)Cc1ccc(-c2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H22O2/c1-17(23)15-18-7-9-20(10-8-18)21-11-13-22(14-12-21)24-16-19-5-3-2-4-6-19/h2-14,17,23H,15-16H2,1H3
InChIKeyRQLXTKDOQWBNTG-UHFFFAOYSA-N
MW318.42 g/mol
LogP4.86
Rot. Bonds6

About 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol

1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol (PubChem CID 18927881) has the molecular formula C22H22O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol.

Molecular Properties

Compound Name1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol
PubChem CID18927881
Molecular FormulaC22H22O2
Molecular Weight318.42 g/mol
Exact Mass318.16
IUPAC Name1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol
SMILESCC(O)Cc1ccc(-c2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H22O2/c1-17(23)15-18-7-9-20(10-8-18)21-11-13-22(14-12-21)24-16-19-5-3-2-4-6-19/h2-14,17,23H,15-16H2,1H3
InChIKeyRQLXTKDOQWBNTG-UHFFFAOYSA-N
XLogP4.86
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(phenylmethoxymethoxy)phenyl]propan-2-ol
CID 102939869
(2R)-1-(4-phenylphenyl)propan-2-ol
CID 92983269
1-[4-(pyridin-4-ylmethoxy)phenyl]propan-2-ol
CID 113323114
(2S)-4-(4-phenylmethoxyphenyl)butan-2-ol
CID 93002881
1-[4-[(3-bromophenyl)methoxy]phenyl]propan-2-ol
CID 115495740
1-(2-phenoxypropyl)-4-phenylmethoxybenzene
CID 150936303
3-(4-phenylmethoxyphenyl)propane-1,2-diol
CID 19868595
1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol
CID 115496013
(2S)-2-amino-3-(4-phenylmethoxyphenyl)propane-1,1-diol
CID 130242612
3-[(4-phenylmethoxyphenyl)methyl]pentane-2,4-dione
CID 10017465
methyl 2-hydroxy-3-(4-phenylmethoxyphenyl)propanoate
CID 10493427
1-chloro-3-methyl-4-(4-phenylmethoxyphenyl)butan-2-one
CID 90999211

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol?
The IUPAC name of 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol (CID 18927881) is 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol.
What is the SMILES notation for 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol?
The canonical SMILES for 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol is CC(O)Cc1ccc(-c2ccc(OCc3ccccc3)cc2)cc1.
What is the InChIKey of 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol?
The InChIKey is RQLXTKDOQWBNTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22O2/c1-17(23)15-18-7-9-20(10-8-18)21-11-13-22(14-12-21)24-16-19-5-3-2-4-6-19/h2-14,17,23H,15-16H2,1H3.
What are the key properties of 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol?
1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol has a molecular weight of 318.42 g/mol, XLogP of 4.86, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol is sourced from PubChem (CID 18927881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).