methyl 2-[(2-methoxyphenoxy)methyl]benzoate

C16H16O4 — CID 82975589

IUPACmethyl 2-[(2-methoxyphenoxy)methyl]benzoate
SMILESCOC(=O)c1ccccc1COc1ccccc1OC
InChIInChI=1S/C16H16O4/c1-18-14-9-5-6-10-15(14)20-11-12-7-3-4-8-13(12)16(17)19-2/h3-10H,11H2,1-2H3
InChIKeyIDUNVJQBVNICNE-UHFFFAOYSA-N
MW272.30 g/mol
LogP3.06
Rot. Bonds5

About methyl 2-[(2-methoxyphenoxy)methyl]benzoate

methyl 2-[(2-methoxyphenoxy)methyl]benzoate (PubChem CID 82975589) has the molecular formula C16H16O4 and a molecular weight of 272.30 g/mol. Its IUPAC name is methyl 2-[(2-methoxyphenoxy)methyl]benzoate.

Molecular Properties

Compound Namemethyl 2-[(2-methoxyphenoxy)methyl]benzoate
PubChem CID82975589
Molecular FormulaC16H16O4
Molecular Weight272.30 g/mol
Exact Mass272.10
IUPAC Namemethyl 2-[(2-methoxyphenoxy)methyl]benzoate
SMILESCOC(=O)c1ccccc1COc1ccccc1OC
InChIInChI=1S/C16H16O4/c1-18-14-9-5-6-10-15(14)20-11-12-7-3-4-8-13(12)16(17)19-2/h3-10H,11H2,1-2H3
InChIKeyIDUNVJQBVNICNE-UHFFFAOYSA-N
XLogP3.06
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(2-methylphenoxy)methyl]benzoate
CID 11043352
2-[(2-methoxyphenoxy)methyl]benzohydrazide
CID 63576535
2-[(2-methoxycarbonylphenoxy)methyl]benzoic acid
CID 70197769
methyl 2-methoxyimino-2-[2-[(2-methoxyphenoxy)methyl]phenyl]acetate
CID 139669220
methyl 2-[(3-hydroxy-2-propylphenoxy)methyl]benzoate
CID 54149611
methyl 2-[(2-bromo-4-methylphenoxy)methyl]benzoate
CID 82976395
ethane;methyl 2-methoxybenzoate
CID 178037044
methyl 2-[[4-[(2-methoxycarbonylphenoxy)methyl]phenyl]methoxy]benzoate
CID 14323673
methyl 2-[[4-(hydroxymethyl)phenoxy]methyl]benzoate
CID 82975676
(2-methoxyphenyl) 2-[(2-chlorophenyl)methoxy]benzoate
CID 2392110
methyl 2-[(5,6-dimethylpyridazin-3-yl)oxymethyl]benzoate
CID 75454570
methyl 2-(propanoyloxymethyl)benzoate
CID 20717774

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2-methoxyphenoxy)methyl]benzoate?
The IUPAC name of methyl 2-[(2-methoxyphenoxy)methyl]benzoate (CID 82975589) is methyl 2-[(2-methoxyphenoxy)methyl]benzoate.
What is the SMILES notation for methyl 2-[(2-methoxyphenoxy)methyl]benzoate?
The canonical SMILES for methyl 2-[(2-methoxyphenoxy)methyl]benzoate is COC(=O)c1ccccc1COc1ccccc1OC.
What is the InChIKey of methyl 2-[(2-methoxyphenoxy)methyl]benzoate?
The InChIKey is IDUNVJQBVNICNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O4/c1-18-14-9-5-6-10-15(14)20-11-12-7-3-4-8-13(12)16(17)19-2/h3-10H,11H2,1-2H3.
What are the key properties of methyl 2-[(2-methoxyphenoxy)methyl]benzoate?
methyl 2-[(2-methoxyphenoxy)methyl]benzoate has a molecular weight of 272.30 g/mol, XLogP of 3.06, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2-methoxyphenoxy)methyl]benzoate is sourced from PubChem (CID 82975589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).