[4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone

C15H14O4 — CID 139738783

IUPAC[4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone
SMILESO=C(c1ccc(OCCO)cc1)c1ccccc1O
InChIInChI=1S/C15H14O4/c16-9-10-19-12-7-5-11(6-8-12)15(18)13-3-1-2-4-14(13)17/h1-8,16-17H,9-10H2
InChIKeyOCABVNZWZALFDV-UHFFFAOYSA-N
MW258.27 g/mol
LogP1.99
Rot. Bonds5

About [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone

[4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone (PubChem CID 139738783) has the molecular formula C15H14O4 and a molecular weight of 258.27 g/mol. Its IUPAC name is [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone.

Molecular Properties

Compound Name[4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone
PubChem CID139738783
Molecular FormulaC15H14O4
Molecular Weight258.27 g/mol
Exact Mass258.09
IUPAC Name[4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone
SMILESO=C(c1ccc(OCCO)cc1)c1ccccc1O
InChIInChI=1S/C15H14O4/c16-9-10-19-12-7-5-11(6-8-12)15(18)13-3-1-2-4-14(13)17/h1-8,16-17H,9-10H2
InChIKeyOCABVNZWZALFDV-UHFFFAOYSA-N
XLogP1.99
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone?
The IUPAC name of [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone (CID 139738783) is [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone.
What is the SMILES notation for [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone?
The canonical SMILES for [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone is O=C(c1ccc(OCCO)cc1)c1ccccc1O.
What is the InChIKey of [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone?
The InChIKey is OCABVNZWZALFDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O4/c16-9-10-19-12-7-5-11(6-8-12)15(18)13-3-1-2-4-14(13)17/h1-8,16-17H,9-10H2.
What are the key properties of [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone?
[4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone has a molecular weight of 258.27 g/mol, XLogP of 1.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-hydroxyethoxy)phenyl]-(2-hydroxyphenyl)methanone is sourced from PubChem (CID 139738783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).