2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate

C19H20O4 — CID 23290048

IUPAC2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate
SMILESC=CC(=O)OCCOCCOc1ccccc1-c1ccccc1
InChIInChI=1S/C19H20O4/c1-2-19(20)23-15-13-21-12-14-22-18-11-7-6-10-17(18)16-8-4-3-5-9-16/h2-11H,1,12-15H2
InChIKeyZYPZRPPGGJNYSX-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.48
Rot. Bonds9

About 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate

2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate (PubChem CID 23290048) has the molecular formula C19H20O4 and a molecular weight of 312.37 g/mol. Its IUPAC name is 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate.

Molecular Properties

Compound Name2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate
PubChem CID23290048
Molecular FormulaC19H20O4
Molecular Weight312.37 g/mol
Exact Mass312.14
IUPAC Name2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate
SMILESC=CC(=O)OCCOCCOc1ccccc1-c1ccccc1
InChIInChI=1S/C19H20O4/c1-2-19(20)23-15-13-21-12-14-22-18-11-7-6-10-17(18)16-8-4-3-5-9-16/h2-11H,1,12-15H2
InChIKeyZYPZRPPGGJNYSX-UHFFFAOYSA-N
XLogP3.48
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-[2-phenyl-4-[3-phenyl-4-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]phenyl]phenoxy]ethoxy]ethoxy]ethyl prop-2-enoate
CID 139696115
2-[2-(2-hydroxyethoxy)phenoxy]ethyl prop-2-enoate
CID 147852586
2-(2-prop-2-enoyloxyethoxy)benzoic acid
CID 18974630
[(2R)-2-hydroxy-3-(2-phenylphenoxy)propyl] prop-2-enoate
CID 129405839
bis[12-(2-phenylphenoxy)dodecyl] (Z)-but-2-enedioate
CID 118941078
methane;2-(4-phenylphenoxy)ethyl prop-2-enoate
CID 159356060
2-[2-(2-phenylphenoxy)ethoxy]ethyl hydrogen sulfite
CID 70626312
2-[5-(2-fluoro-4-phenylphenyl)-2-(hydroxymethyl)phenoxy]ethyl prop-2-enoate
CID 134200809
[2-phenyl-6-(6-prop-2-enoyloxyhexoxy)phenyl] benzoate
CID 139987175
2-[4-[9-[3,5-diphenyl-4-(2-prop-2-enoyloxyethoxy)phenyl]fluoren-9-yl]-2,6-diphenylphenoxy]ethyl prop-2-enoate
CID 163736073
2-(2,3-diaminophenoxy)ethyl prop-2-enoate
CID 141212699
2-(2-propylphenoxy)ethyl prop-2-enoate
CID 154077444

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate?
The IUPAC name of 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate (CID 23290048) is 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate.
What is the SMILES notation for 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate?
The canonical SMILES for 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate is C=CC(=O)OCCOCCOc1ccccc1-c1ccccc1.
What is the InChIKey of 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate?
The InChIKey is ZYPZRPPGGJNYSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O4/c1-2-19(20)23-15-13-21-12-14-22-18-11-7-6-10-17(18)16-8-4-3-5-9-16/h2-11H,1,12-15H2.
What are the key properties of 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate?
2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate has a molecular weight of 312.37 g/mol, XLogP of 3.48, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-phenylphenoxy)ethoxy]ethyl prop-2-enoate is sourced from PubChem (CID 23290048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).