(2-hydroxy-5-methoxyphenyl)-phenylmethanone

C14H12O3 — CID 26881

IUPAC(2-hydroxy-5-methoxyphenyl)-phenylmethanone
SMILESCOc1ccc(O)c(C(=O)c2ccccc2)c1
InChIInChI=1S/C14H12O3/c1-17-11-7-8-13(15)12(9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3
InChIKeyRIFCEURUCJPMOQ-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.63
Rot. Bonds3

About (2-hydroxy-5-methoxyphenyl)-phenylmethanone

(2-hydroxy-5-methoxyphenyl)-phenylmethanone (PubChem CID 26881) has the molecular formula C14H12O3 and a molecular weight of 228.25 g/mol. Its IUPAC name is (2-hydroxy-5-methoxyphenyl)-phenylmethanone.

Molecular Properties

Compound Name(2-hydroxy-5-methoxyphenyl)-phenylmethanone
PubChem CID26881
Molecular FormulaC14H12O3
Molecular Weight228.25 g/mol
Exact Mass228.08
IUPAC Name(2-hydroxy-5-methoxyphenyl)-phenylmethanone
SMILESCOc1ccc(O)c(C(=O)c2ccccc2)c1
InChIInChI=1S/C14H12O3/c1-17-11-7-8-13(15)12(9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3
InChIKeyRIFCEURUCJPMOQ-UHFFFAOYSA-N
XLogP2.63
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Hydroxy-4-methoxybenzophenone
CID 4632
Flavonol
CID 11349
5-Methoxysalicylic Acid
CID 75787
2'-Hydroxychalcone
CID 638276
6-Methoxyflavone
CID 147157
Isoflavone
CID 72304
3-Methoxybenzoic Acid
CID 11461
2-Acetylhydroquinone
CID 10279
6-Hydroxyflavone
CID 72279
2'-Hydroxyflavone
CID 161860
2'-Methoxyacetophenone
CID 68481
3-Methylchromone
CID 66569

Frequently Asked Questions

What is the IUPAC name of (2-hydroxy-5-methoxyphenyl)-phenylmethanone?
The IUPAC name of (2-hydroxy-5-methoxyphenyl)-phenylmethanone (CID 26881) is (2-hydroxy-5-methoxyphenyl)-phenylmethanone.
What is the SMILES notation for (2-hydroxy-5-methoxyphenyl)-phenylmethanone?
The canonical SMILES for (2-hydroxy-5-methoxyphenyl)-phenylmethanone is COc1ccc(O)c(C(=O)c2ccccc2)c1.
What is the InChIKey of (2-hydroxy-5-methoxyphenyl)-phenylmethanone?
The InChIKey is RIFCEURUCJPMOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O3/c1-17-11-7-8-13(15)12(9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3.
What are the key properties of (2-hydroxy-5-methoxyphenyl)-phenylmethanone?
(2-hydroxy-5-methoxyphenyl)-phenylmethanone has a molecular weight of 228.25 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxy-5-methoxyphenyl)-phenylmethanone is sourced from PubChem (CID 26881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).