ethyl 2-(6-methoxynaphthalen-2-yl)acetate

C15H16O3 — CID 11265053

IUPACethyl 2-(6-methoxynaphthalen-2-yl)acetate
SMILESCCOC(=O)Cc1ccc2cc(OC)ccc2c1
InChIInChI=1S/C15H16O3/c1-3-18-15(16)9-11-4-5-13-10-14(17-2)7-6-12(13)8-11/h4-8,10H,3,9H2,1-2H3
InChIKeyCXCLAWBRYZEURO-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.95
Rot. Bonds4

About ethyl 2-(6-methoxynaphthalen-2-yl)acetate

ethyl 2-(6-methoxynaphthalen-2-yl)acetate (PubChem CID 11265053) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is ethyl 2-(6-methoxynaphthalen-2-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(6-methoxynaphthalen-2-yl)acetate
PubChem CID11265053
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Nameethyl 2-(6-methoxynaphthalen-2-yl)acetate
SMILESCCOC(=O)Cc1ccc2cc(OC)ccc2c1
InChIInChI=1S/C15H16O3/c1-3-18-15(16)9-11-4-5-13-10-14(17-2)7-6-12(13)8-11/h4-8,10H,3,9H2,1-2H3
InChIKeyCXCLAWBRYZEURO-UHFFFAOYSA-N
XLogP2.95
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(6-methoxynaphthalen-2-yl)acetate?
The IUPAC name of ethyl 2-(6-methoxynaphthalen-2-yl)acetate (CID 11265053) is ethyl 2-(6-methoxynaphthalen-2-yl)acetate.
What is the SMILES notation for ethyl 2-(6-methoxynaphthalen-2-yl)acetate?
The canonical SMILES for ethyl 2-(6-methoxynaphthalen-2-yl)acetate is CCOC(=O)Cc1ccc2cc(OC)ccc2c1.
What is the InChIKey of ethyl 2-(6-methoxynaphthalen-2-yl)acetate?
The InChIKey is CXCLAWBRYZEURO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3/c1-3-18-15(16)9-11-4-5-13-10-14(17-2)7-6-12(13)8-11/h4-8,10H,3,9H2,1-2H3.
What are the key properties of ethyl 2-(6-methoxynaphthalen-2-yl)acetate?
ethyl 2-(6-methoxynaphthalen-2-yl)acetate has a molecular weight of 244.29 g/mol, XLogP of 2.95, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(6-methoxynaphthalen-2-yl)acetate is sourced from PubChem (CID 11265053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).