methyl 4-(2-methoxybenzoyl)benzoate

C16H14O4 — CID 22408243

IUPACmethyl 4-(2-methoxybenzoyl)benzoate
SMILESCOC(=O)c1ccc(C(=O)c2ccccc2OC)cc1
InChIInChI=1S/C16H14O4/c1-19-14-6-4-3-5-13(14)15(17)11-7-9-12(10-8-11)16(18)20-2/h3-10H,1-2H3
InChIKeyPIUMKSIDYZLWMG-UHFFFAOYSA-N
MW270.28 g/mol
LogP2.71
Rot. Bonds4

About methyl 4-(2-methoxybenzoyl)benzoate

methyl 4-(2-methoxybenzoyl)benzoate (PubChem CID 22408243) has the molecular formula C16H14O4 and a molecular weight of 270.28 g/mol. Its IUPAC name is methyl 4-(2-methoxybenzoyl)benzoate.

Molecular Properties

Compound Namemethyl 4-(2-methoxybenzoyl)benzoate
PubChem CID22408243
Molecular FormulaC16H14O4
Molecular Weight270.28 g/mol
Exact Mass270.09
IUPAC Namemethyl 4-(2-methoxybenzoyl)benzoate
SMILESCOC(=O)c1ccc(C(=O)c2ccccc2OC)cc1
InChIInChI=1S/C16H14O4/c1-19-14-6-4-3-5-13(14)15(17)11-7-9-12(10-8-11)16(18)20-2/h3-10H,1-2H3
InChIKeyPIUMKSIDYZLWMG-UHFFFAOYSA-N
XLogP2.71
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;methyl 2-methoxybenzoate
CID 178037044
(2-methoxyphenyl)-(4-methylsulfonylphenyl)methanone
CID 114962795
(3,4-dimethylphenyl)-(2-methoxyphenyl)methanone
CID 24722768
[2-(2-methoxyphenoxy)phenyl]-phenylmethanone
CID 157433245
methyl 4-[2-(bromomethyl)benzoyl]benzoate
CID 58257260
methyl 4-[2-[2-[2-[2-[2-[2-[2-[2-(difluoromethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]benzoyl]benzoate
CID 140747936
(4-benzoylphenyl) 2-methoxybenzoate
CID 1234638
methyl 4-[[(2-methoxybenzoyl)hydrazinylidene]methyl]benzoate
CID 3669406
[4-(2-methoxybenzoyl)phenyl] 2-methylprop-2-enoate
CID 139968498
methyl 2-(2,6-dimethoxybenzoyl)benzoate
CID 71397959
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
2-methoxy-4-(2-methoxybenzoyl)benzaldehyde
CID 10825897

Frequently Asked Questions

What is the IUPAC name of methyl 4-(2-methoxybenzoyl)benzoate?
The IUPAC name of methyl 4-(2-methoxybenzoyl)benzoate (CID 22408243) is methyl 4-(2-methoxybenzoyl)benzoate.
What is the SMILES notation for methyl 4-(2-methoxybenzoyl)benzoate?
The canonical SMILES for methyl 4-(2-methoxybenzoyl)benzoate is COC(=O)c1ccc(C(=O)c2ccccc2OC)cc1.
What is the InChIKey of methyl 4-(2-methoxybenzoyl)benzoate?
The InChIKey is PIUMKSIDYZLWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14O4/c1-19-14-6-4-3-5-13(14)15(17)11-7-9-12(10-8-11)16(18)20-2/h3-10H,1-2H3.
What are the key properties of methyl 4-(2-methoxybenzoyl)benzoate?
methyl 4-(2-methoxybenzoyl)benzoate has a molecular weight of 270.28 g/mol, XLogP of 2.71, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-(2-methoxybenzoyl)benzoate is sourced from PubChem (CID 22408243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).