ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate

C18H20O4 — CID 11974612

IUPACethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate
SMILESCCOC(=O)Cc1ccccc1OCc1ccc(OC)cc1
InChIInChI=1S/C18H20O4/c1-3-21-18(19)12-15-6-4-5-7-17(15)22-13-14-8-10-16(20-2)11-9-14/h4-11H,3,12-13H2,1-2H3
InChIKeyBHSNSQFIZDSHKI-UHFFFAOYSA-N
MW300.35 g/mol
LogP3.38
Rot. Bonds7

About ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate

ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate (PubChem CID 11974612) has the molecular formula C18H20O4 and a molecular weight of 300.35 g/mol. Its IUPAC name is ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate.

Molecular Properties

Compound Nameethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate
PubChem CID11974612
Molecular FormulaC18H20O4
Molecular Weight300.35 g/mol
Exact Mass300.14
IUPAC Nameethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate
SMILESCCOC(=O)Cc1ccccc1OCc1ccc(OC)cc1
InChIInChI=1S/C18H20O4/c1-3-21-18(19)12-15-6-4-5-7-17(15)22-13-14-8-10-16(20-2)11-9-14/h4-11H,3,12-13H2,1-2H3
InChIKeyBHSNSQFIZDSHKI-UHFFFAOYSA-N
XLogP3.38
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.35
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methoxyphenyl)methyl 2-(4-methoxyphenyl)acetate
CID 78760060
2-[2-[(4-methylphenyl)methoxy]phenyl]acetic acid
CID 80741371
ethyl 2-[2-[(8-bromoquinolin-6-yl)methoxy]phenyl]acetate
CID 139561384
ethyl 2-(6-methoxynaphthalen-2-yl)acetate
CID 11265053
ethyl 2-[2-[[7-(2-ethylphenyl)-1-benzofuran-5-yl]methoxy]phenyl]acetate
CID 157458873
ethyl 2-[2-[(7-bromo-2-chloro-1-benzofuran-5-yl)methoxy]phenyl]acetate
CID 139561061
1-(4-methoxyphenyl)-N-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]methanamine
CID 17054326
N-[(2-ethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 38009470
ethyl 2-[2-[[7-iodo-2-[[(5-methoxy-3-pyridinyl)amino]methyl]-1-benzofuran-5-yl]methoxy]phenyl]acetate
CID 139561063
1-hydroxy-1-[2-[2-[2-[(4-methoxyphenyl)methoxy]phenyl]ethylamino]ethyl]urea
CID 19761842
ethyl 2-[2-[[7-iodo-2-(phenylmethoxymethyl)-1-benzofuran-5-yl]methoxy]phenyl]acetate
CID 139560775
1-ethyl-2-[(4-ethylphenyl)methoxy]benzene
CID 64764755

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate?
The IUPAC name of ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate (CID 11974612) is ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate.
What is the SMILES notation for ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate?
The canonical SMILES for ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate is CCOC(=O)Cc1ccccc1OCc1ccc(OC)cc1.
What is the InChIKey of ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate?
The InChIKey is BHSNSQFIZDSHKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O4/c1-3-21-18(19)12-15-6-4-5-7-17(15)22-13-14-8-10-16(20-2)11-9-14/h4-11H,3,12-13H2,1-2H3.
What are the key properties of ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate?
ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate has a molecular weight of 300.35 g/mol, XLogP of 3.38, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-[(4-methoxyphenyl)methoxy]phenyl]acetate is sourced from PubChem (CID 11974612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).