2-naphthalen-2-yloxyethyl formate

C13H12O3 — CID 54350487

IUPAC2-naphthalen-2-yloxyethyl formate
SMILESO=COCCOc1ccc2ccccc2c1
InChIInChI=1S/C13H12O3/c14-10-15-7-8-16-13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9-10H,7-8H2
InChIKeyOGYWPKIEYJEBQL-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.39
Rot. Bonds5

About 2-naphthalen-2-yloxyethyl formate

2-naphthalen-2-yloxyethyl formate (PubChem CID 54350487) has the molecular formula C13H12O3 and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-naphthalen-2-yloxyethyl formate.

Molecular Properties

Compound Name2-naphthalen-2-yloxyethyl formate
PubChem CID54350487
Molecular FormulaC13H12O3
Molecular Weight216.24 g/mol
Exact Mass216.08
IUPAC Name2-naphthalen-2-yloxyethyl formate
SMILESO=COCCOc1ccc2ccccc2c1
InChIInChI=1S/C13H12O3/c14-10-15-7-8-16-13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9-10H,7-8H2
InChIKeyOGYWPKIEYJEBQL-UHFFFAOYSA-N
XLogP2.39
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-naphthalen-2-yloxyacetaldehyde
CID 15670594
2-(2-phenoxyethoxy)ethyl formate
CID 88533287
[4-(2-naphthalen-2-yloxyethoxy)phenyl]methanamine
CID 20990903
3-methoxy-2-(2-naphthalen-2-yloxyethoxy)benzaldehyde
CID 22685612
(E)-3-[3-(2-formyloxyethoxy)phenyl]prop-2-enoic acid
CID 173454155
2-(3-phenylpropoxy)naphthalene
CID 13432986
2-(9-bromononoxy)naphthalene
CID 105343234
11-naphthalen-2-yloxyundecan-1-ol
CID 164916130
2,6-dichloro-4-(2-naphthalen-2-yloxyethoxy)benzonitrile
CID 19004507
2-ethoxynaphthalene
CID 118978197
sodium;hydride;2-[4-(2-naphthalen-2-yloxyethoxy)phenyl]-2-oxoacetic acid
CID 173336218
(NE)-N-[[3-(2-naphthalen-2-yloxyethoxy)phenyl]methylidene]hydroxylamine
CID 42180901

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxyethyl formate?
The IUPAC name of 2-naphthalen-2-yloxyethyl formate (CID 54350487) is 2-naphthalen-2-yloxyethyl formate.
What is the SMILES notation for 2-naphthalen-2-yloxyethyl formate?
The canonical SMILES for 2-naphthalen-2-yloxyethyl formate is O=COCCOc1ccc2ccccc2c1.
What is the InChIKey of 2-naphthalen-2-yloxyethyl formate?
The InChIKey is OGYWPKIEYJEBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O3/c14-10-15-7-8-16-13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9-10H,7-8H2.
What are the key properties of 2-naphthalen-2-yloxyethyl formate?
2-naphthalen-2-yloxyethyl formate has a molecular weight of 216.24 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxyethyl formate is sourced from PubChem (CID 54350487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).