[4-(4-ethylphenyl)phenyl] formate

C15H14O2 — CID 1393715

IUPAC[4-(4-ethylphenyl)phenyl] formate
SMILESCCc1ccc(-c2ccc(OC=O)cc2)cc1
InChIInChI=1S/C15H14O2/c1-2-12-3-5-13(6-4-12)14-7-9-15(10-8-14)17-11-16/h3-11H,2H2,1H3
InChIKeyILIJAHHNSGRUIE-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.45
Rot. Bonds4

About [4-(4-ethylphenyl)phenyl] formate

[4-(4-ethylphenyl)phenyl] formate (PubChem CID 1393715) has the molecular formula C15H14O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is [4-(4-ethylphenyl)phenyl] formate.

Molecular Properties

Compound Name[4-(4-ethylphenyl)phenyl] formate
PubChem CID1393715
Molecular FormulaC15H14O2
Molecular Weight226.28 g/mol
Exact Mass226.10
IUPAC Name[4-(4-ethylphenyl)phenyl] formate
SMILESCCc1ccc(-c2ccc(OC=O)cc2)cc1
InChIInChI=1S/C15H14O2/c1-2-12-3-5-13(6-4-12)14-7-9-15(10-8-14)17-11-16/h3-11H,2H2,1H3
InChIKeyILIJAHHNSGRUIE-UHFFFAOYSA-N
XLogP3.45
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 174654001
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CID 123337732
CID 123337732
(4-ethylphenyl) (4-phenylphenyl) carbonate
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1-ethyl-4-[(E)-pent-1-enoxy]benzene
CID 89304305
1,4-bis[(4-ethylphenyl)methyl]benzene;ethane;1-ethyl-4-[[4-[4-[(4-ethylphenyl)methyl]phenyl]phenyl]methyl]benzene
CID 163605506
[4-(4-formyloxyphenyl)phenyl] 2-methylprop-2-enoate;2-methylprop-1-ene
CID 144966682
(6-ethyl-3-pyridinyl) formate
CID 174587869
1,3-diethylbenzene;1,4-diethylbenzene;1,4-dimethoxybenzene;1-ethyl-4-methoxybenzene;1-methoxy-4-(4-methoxyphenyl)benzene;pentahydrate
CID 159257334
1-ethyl-4-(4-fluorophenyl)benzene
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[4-[4-[4-(4-ethylphenyl)phenyl]phenyl]phenyl]methanethiol
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Frequently Asked Questions

What is the IUPAC name of [4-(4-ethylphenyl)phenyl] formate?
The IUPAC name of [4-(4-ethylphenyl)phenyl] formate (CID 1393715) is [4-(4-ethylphenyl)phenyl] formate.
What is the SMILES notation for [4-(4-ethylphenyl)phenyl] formate?
The canonical SMILES for [4-(4-ethylphenyl)phenyl] formate is CCc1ccc(-c2ccc(OC=O)cc2)cc1.
What is the InChIKey of [4-(4-ethylphenyl)phenyl] formate?
The InChIKey is ILIJAHHNSGRUIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-2-12-3-5-13(6-4-12)14-7-9-15(10-8-14)17-11-16/h3-11H,2H2,1H3.
What are the key properties of [4-(4-ethylphenyl)phenyl] formate?
[4-(4-ethylphenyl)phenyl] formate has a molecular weight of 226.28 g/mol, XLogP of 3.45, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-ethylphenyl)phenyl] formate is sourced from PubChem (CID 1393715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).