phenol;1-phenylethenylbenzene

C20H18O — CID 174309625

IUPACphenol;1-phenylethenylbenzene
SMILESC=C(c1ccccc1)c1ccccc1.Oc1ccccc1
InChIInChI=1S/C14H12.C6H6O/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;7-6-4-2-1-3-5-6/h2-11H,1H2;1-5,7H
InChIKeyRUJDXHLHQLAWIP-UHFFFAOYSA-N
MW274.36 g/mol
LogP5.14
Rot. Bonds2

About phenol;1-phenylethenylbenzene

phenol;1-phenylethenylbenzene (PubChem CID 174309625) has the molecular formula C20H18O and a molecular weight of 274.36 g/mol. Its IUPAC name is phenol;1-phenylethenylbenzene.

Molecular Properties

Compound Namephenol;1-phenylethenylbenzene
PubChem CID174309625
Molecular FormulaC20H18O
Molecular Weight274.36 g/mol
Exact Mass274.14
IUPAC Namephenol;1-phenylethenylbenzene
SMILESC=C(c1ccccc1)c1ccccc1.Oc1ccccc1
InChIInChI=1S/C14H12.C6H6O/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;7-6-4-2-1-3-5-6/h2-11H,1H2;1-5,7H
InChIKeyRUJDXHLHQLAWIP-UHFFFAOYSA-N
XLogP5.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.36
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-phenylethenylbenzene;hydrochloride
CID 70400725
potassium 1-phenylethenylbenzene
CID 19358731
mercury(1+);1-phenylethenylbenzene;chloride
CID 171374959
ethene;phenol
CID 22228706
phenol;1,2,2-triphenylethenylbenzene
CID 159416986
aluminum phenol
CID 19023057
CID 159904044
CID 159904044
molybdenum;phenol
CID 154246724
argon;phenol
CID 159678450
CID 67496590
CID 67496590
phenol;phosphane
CID 159689182
phenol;tantalum
CID 19915613

Frequently Asked Questions

What is the IUPAC name of phenol;1-phenylethenylbenzene?
The IUPAC name of phenol;1-phenylethenylbenzene (CID 174309625) is phenol;1-phenylethenylbenzene.
What is the SMILES notation for phenol;1-phenylethenylbenzene?
The canonical SMILES for phenol;1-phenylethenylbenzene is C=C(c1ccccc1)c1ccccc1.Oc1ccccc1.
What is the InChIKey of phenol;1-phenylethenylbenzene?
The InChIKey is RUJDXHLHQLAWIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12.C6H6O/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14;7-6-4-2-1-3-5-6/h2-11H,1H2;1-5,7H.
What are the key properties of phenol;1-phenylethenylbenzene?
phenol;1-phenylethenylbenzene has a molecular weight of 274.36 g/mol, XLogP of 5.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenol;1-phenylethenylbenzene is sourced from PubChem (CID 174309625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).