1-(furan-2-yl)ethyl 2-phenylacetate

C14H14O3 — CID 14353399

IUPAC1-(furan-2-yl)ethyl 2-phenylacetate
SMILESCC(OC(=O)Cc1ccccc1)c1ccco1
InChIInChI=1S/C14H14O3/c1-11(13-8-5-9-16-13)17-14(15)10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3
InChIKeyRZRIMAKKYFZLMO-UHFFFAOYSA-N
MW230.26 g/mol
LogP3.13
Rot. Bonds4

About 1-(furan-2-yl)ethyl 2-phenylacetate

1-(furan-2-yl)ethyl 2-phenylacetate (PubChem CID 14353399) has the molecular formula C14H14O3 and a molecular weight of 230.26 g/mol. Its IUPAC name is 1-(furan-2-yl)ethyl 2-phenylacetate.

Molecular Properties

Compound Name1-(furan-2-yl)ethyl 2-phenylacetate
PubChem CID14353399
Molecular FormulaC14H14O3
Molecular Weight230.26 g/mol
Exact Mass230.09
IUPAC Name1-(furan-2-yl)ethyl 2-phenylacetate
SMILESCC(OC(=O)Cc1ccccc1)c1ccco1
InChIInChI=1S/C14H14O3/c1-11(13-8-5-9-16-13)17-14(15)10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3
InChIKeyRZRIMAKKYFZLMO-UHFFFAOYSA-N
XLogP3.13
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[(1S)-1-phenylethyl] 2-phenylacetate
CID 70824875
oxophosphanium;propan-2-yl 2-phenylacetate
CID 159678340
1-bromoethyl 2-phenylacetate
CID 22386448
1-phenylbutan-2-yl 2-phenylacetate
CID 86053968
1-(dimethylamino)ethyl 2-phenylacetate
CID 88661320
1-bromopropan-2-yl 2-phenylacetate
CID 102297805
1,3-dihydroxypropan-2-yl 2-(4-benzylphenyl)acetate
CID 56950597
(4-fluoro-3-hydroxybutan-2-yl) 2-phenylacetate
CID 54393447
1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl 2-phenylacetate
CID 55553350
(2S)-2-(2-phenylacetyl)oxybutanoic acid
CID 124585457
1-phenylethyl 2-[4-(2-methylbutan-2-yl)phenyl]acetate
CID 59776169
[1-[di(propan-2-yl)amino]-1-oxopropan-2-yl] 2-phenylacetate
CID 55417641

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)ethyl 2-phenylacetate?
The IUPAC name of 1-(furan-2-yl)ethyl 2-phenylacetate (CID 14353399) is 1-(furan-2-yl)ethyl 2-phenylacetate.
What is the SMILES notation for 1-(furan-2-yl)ethyl 2-phenylacetate?
The canonical SMILES for 1-(furan-2-yl)ethyl 2-phenylacetate is CC(OC(=O)Cc1ccccc1)c1ccco1.
What is the InChIKey of 1-(furan-2-yl)ethyl 2-phenylacetate?
The InChIKey is RZRIMAKKYFZLMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O3/c1-11(13-8-5-9-16-13)17-14(15)10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3.
What are the key properties of 1-(furan-2-yl)ethyl 2-phenylacetate?
1-(furan-2-yl)ethyl 2-phenylacetate has a molecular weight of 230.26 g/mol, XLogP of 3.13, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)ethyl 2-phenylacetate is sourced from PubChem (CID 14353399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).