1-ethoxy-4-phenylbenzene;phenol

C20H20O2 — CID 174652155

IUPAC1-ethoxy-4-phenylbenzene;phenol
SMILESCCOc1ccc(-c2ccccc2)cc1.Oc1ccccc1
InChIInChI=1S/C14H14O.C6H6O/c1-2-15-14-10-8-13(9-11-14)12-6-4-3-5-7-12;7-6-4-2-1-3-5-6/h3-11H,2H2,1H3;1-5,7H
InChIKeyQAPYQWUULCKAKU-UHFFFAOYSA-N
MW292.38 g/mol
LogP5.14
Rot. Bonds3

About 1-ethoxy-4-phenylbenzene;phenol

1-ethoxy-4-phenylbenzene;phenol (PubChem CID 174652155) has the molecular formula C20H20O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-ethoxy-4-phenylbenzene;phenol.

Molecular Properties

Compound Name1-ethoxy-4-phenylbenzene;phenol
PubChem CID174652155
Molecular FormulaC20H20O2
Molecular Weight292.38 g/mol
Exact Mass292.15
IUPAC Name1-ethoxy-4-phenylbenzene;phenol
SMILESCCOc1ccc(-c2ccccc2)cc1.Oc1ccccc1
InChIInChI=1S/C14H14O.C6H6O/c1-2-15-14-10-8-13(9-11-14)12-6-4-3-5-7-12;7-6-4-2-1-3-5-6/h3-11H,2H2,1H3;1-5,7H
InChIKeyQAPYQWUULCKAKU-UHFFFAOYSA-N
XLogP5.14
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.38
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

bis(1,1'-biphenyl);ethane;phenol;propane
CID 159973913
(4-phenylphenyl) 2-(4-ethoxyphenoxy)acetate
CID 19177827
1-(ethoxymethoxy)-4-phenylbenzene
CID 146557132
1,4-dibutoxybenzene;phenol
CID 174756360
1,1'-biphenyl;4-octadecoxyphenol
CID 158943857
2-(4-ethoxyphenyl)-6-phenylthiopyrylium
CID 154276267
ethoxybenzene chloride
CID 21193593
1-methoxy-4-phenylbenzene;4-(4-methoxyphenyl)phenol
CID 69347648
benzene;1,1'-biphenyl;phenol
CID 159528072
ethoxybenzene tetrafluoroborate
CID 174807216
(4-phenylphenoxy)methanol
CID 71028246
ethoxybenzene;molecular iodine
CID 67763605

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-4-phenylbenzene;phenol?
The IUPAC name of 1-ethoxy-4-phenylbenzene;phenol (CID 174652155) is 1-ethoxy-4-phenylbenzene;phenol.
What is the SMILES notation for 1-ethoxy-4-phenylbenzene;phenol?
The canonical SMILES for 1-ethoxy-4-phenylbenzene;phenol is CCOc1ccc(-c2ccccc2)cc1.Oc1ccccc1.
What is the InChIKey of 1-ethoxy-4-phenylbenzene;phenol?
The InChIKey is QAPYQWUULCKAKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O.C6H6O/c1-2-15-14-10-8-13(9-11-14)12-6-4-3-5-7-12;7-6-4-2-1-3-5-6/h3-11H,2H2,1H3;1-5,7H.
What are the key properties of 1-ethoxy-4-phenylbenzene;phenol?
1-ethoxy-4-phenylbenzene;phenol has a molecular weight of 292.38 g/mol, XLogP of 5.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-4-phenylbenzene;phenol is sourced from PubChem (CID 174652155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).