methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate

C17H16O5 — CID 7894205

IUPACmethyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate
SMILESCOC(=O)c1ccc(COc2ccccc2C(=O)OC)cc1
InChIInChI=1S/C17H16O5/c1-20-16(18)13-9-7-12(8-10-13)11-22-15-6-4-3-5-14(15)17(19)21-2/h3-10H,11H2,1-2H3
InChIKeyZWHWONXOZXGPBE-UHFFFAOYSA-N
MW300.31 g/mol
LogP2.84
Rot. Bonds5

About methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate

methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate (PubChem CID 7894205) has the molecular formula C17H16O5 and a molecular weight of 300.31 g/mol. Its IUPAC name is methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate.

Molecular Properties

Compound Namemethyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate
PubChem CID7894205
Molecular FormulaC17H16O5
Molecular Weight300.31 g/mol
Exact Mass300.10
IUPAC Namemethyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate
SMILESCOC(=O)c1ccc(COc2ccccc2C(=O)OC)cc1
InChIInChI=1S/C17H16O5/c1-20-16(18)13-9-7-12(8-10-13)11-22-15-6-4-3-5-14(15)17(19)21-2/h3-10H,11H2,1-2H3
InChIKeyZWHWONXOZXGPBE-UHFFFAOYSA-N
XLogP2.84
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[[4-[(2-methoxycarbonylphenoxy)methyl]phenyl]methoxy]benzoate
CID 14323673
methyl 4-[(2-acetylphenoxy)methyl]benzoate
CID 9172369
methyl 2-[[4-[(2-acetylphenoxy)methyl]phenyl]methoxy]benzoate
CID 59575964
methyl 4-[[2-(benzylcarbamoyl)phenoxy]methyl]benzoate
CID 7981645
methyl 4-[(2-phenylmethoxybenzoyl)amino]benzoate
CID 4946351
(4-methoxycarbonylphenyl)methyl 2-(2-phenoxyethoxy)benzoate
CID 2379646
methyl 2-[2-[(4-carbamimidoylphenyl)methoxy]phenyl]benzoate
CID 22626508
methyl 2-[4-(bromomethyl)benzoyl]oxybenzoate
CID 42631900
methyl 2-[2-[2-(2-methoxycarbonylphenoxy)ethoxy]ethoxy]benzoate
CID 15209322
ethyl 4-[(2-acetylphenoxy)methyl]benzoate
CID 82312048
methyl 3-acetyl-4-phenylmethoxybenzoate
CID 22101033
(4-methoxycarbonylphenyl)methyl 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate
CID 8731714

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate?
The IUPAC name of methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate (CID 7894205) is methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate.
What is the SMILES notation for methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate?
The canonical SMILES for methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate is COC(=O)c1ccc(COc2ccccc2C(=O)OC)cc1.
What is the InChIKey of methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate?
The InChIKey is ZWHWONXOZXGPBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O5/c1-20-16(18)13-9-7-12(8-10-13)11-22-15-6-4-3-5-14(15)17(19)21-2/h3-10H,11H2,1-2H3.
What are the key properties of methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate?
methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate has a molecular weight of 300.31 g/mol, XLogP of 2.84, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate is sourced from PubChem (CID 7894205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).