2-methyl-5-(3-phenylmethoxyphenyl)phenol

C20H18O2 — CID 53219180

IUPAC2-methyl-5-(3-phenylmethoxyphenyl)phenol
SMILESCc1ccc(-c2cccc(OCc3ccccc3)c2)cc1O
InChIInChI=1S/C20H18O2/c1-15-10-11-18(13-20(15)21)17-8-5-9-19(12-17)22-14-16-6-3-2-4-7-16/h2-13,21H,14H2,1H3
InChIKeyCBBXNBMHIGVTGR-UHFFFAOYSA-N
MW290.36 g/mol
LogP4.95
Rot. Bonds4

About 2-methyl-5-(3-phenylmethoxyphenyl)phenol

2-methyl-5-(3-phenylmethoxyphenyl)phenol (PubChem CID 53219180) has the molecular formula C20H18O2 and a molecular weight of 290.36 g/mol. Its IUPAC name is 2-methyl-5-(3-phenylmethoxyphenyl)phenol.

Molecular Properties

Compound Name2-methyl-5-(3-phenylmethoxyphenyl)phenol
PubChem CID53219180
Molecular FormulaC20H18O2
Molecular Weight290.36 g/mol
Exact Mass290.13
IUPAC Name2-methyl-5-(3-phenylmethoxyphenyl)phenol
SMILESCc1ccc(-c2cccc(OCc3ccccc3)c2)cc1O
InChIInChI=1S/C20H18O2/c1-15-10-11-18(13-20(15)21)17-8-5-9-19(12-17)22-14-16-6-3-2-4-7-16/h2-13,21H,14H2,1H3
InChIKeyCBBXNBMHIGVTGR-UHFFFAOYSA-N
XLogP4.95
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-hydroxy-5-(3-phenylmethoxyphenyl)phenyl]ethanone
CID 23004910
2-methyl-4-(3-phenylmethoxyphenyl)-1-propan-2-ylsulfanylbenzene
CID 166899428
2-methyl-5-[(3-methylphenoxy)methyl]phenol
CID 117221818
2-phenyl-5-phenylmethoxyphenol
CID 123808909
1-ethynyl-3-methyl-5-(3-phenylmethoxyphenyl)benzene
CID 167311917
5-[(3-bromophenoxy)methyl]-2-methylphenol
CID 117221825
[3-ethyl-5-(3-phenylmethoxyphenyl)phenyl]methanol
CID 122435033
5-phenyl-2-phenylmethoxyphenol
CID 11994792
1,3-diphenylbenzene;4-phenylmethoxyphenol
CID 70041760
3-[3-(3-phenylmethoxyphenyl)phenyl]propanoic acid
CID 58239597
2-[2-chloro-4-(3-phenylmethoxyphenyl)phenyl]acetic acid
CID 176516199
ethyl (2R)-2-amino-3-[3-(3-phenylmethoxyphenyl)phenyl]propanoate
CID 154815416

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(3-phenylmethoxyphenyl)phenol?
The IUPAC name of 2-methyl-5-(3-phenylmethoxyphenyl)phenol (CID 53219180) is 2-methyl-5-(3-phenylmethoxyphenyl)phenol.
What is the SMILES notation for 2-methyl-5-(3-phenylmethoxyphenyl)phenol?
The canonical SMILES for 2-methyl-5-(3-phenylmethoxyphenyl)phenol is Cc1ccc(-c2cccc(OCc3ccccc3)c2)cc1O.
What is the InChIKey of 2-methyl-5-(3-phenylmethoxyphenyl)phenol?
The InChIKey is CBBXNBMHIGVTGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18O2/c1-15-10-11-18(13-20(15)21)17-8-5-9-19(12-17)22-14-16-6-3-2-4-7-16/h2-13,21H,14H2,1H3.
What are the key properties of 2-methyl-5-(3-phenylmethoxyphenyl)phenol?
2-methyl-5-(3-phenylmethoxyphenyl)phenol has a molecular weight of 290.36 g/mol, XLogP of 4.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(3-phenylmethoxyphenyl)phenol is sourced from PubChem (CID 53219180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).