4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol

C22H16O — CID 139980470

IUPAC4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol
SMILESOc1ccc(/C=C/c2cccc3ccccc23)c2ccccc12
InChIInChI=1S/C22H16O/c23-22-15-14-18(20-10-3-4-11-21(20)22)13-12-17-8-5-7-16-6-1-2-9-19(16)17/h1-15,23H/b13-12+
InChIKeySHLOFXJVRZVJPT-OUKQBFOZSA-N
MW296.37 g/mol
LogP5.87
Rot. Bonds2

About 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol

4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol (PubChem CID 139980470) has the molecular formula C22H16O and a molecular weight of 296.37 g/mol. Its IUPAC name is 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol.

Molecular Properties

Compound Name4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol
PubChem CID139980470
Molecular FormulaC22H16O
Molecular Weight296.37 g/mol
Exact Mass296.12
IUPAC Name4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol
SMILESOc1ccc(/C=C/c2cccc3ccccc23)c2ccccc12
InChIInChI=1S/C22H16O/c23-22-15-14-18(20-10-3-4-11-21(20)22)13-12-17-8-5-7-16-6-1-2-9-19(16)17/h1-15,23H/b13-12+
InChIKeySHLOFXJVRZVJPT-OUKQBFOZSA-N
XLogP5.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.37
LogP ≤ 55.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-[2-[2,4,5-tris(2-naphthalen-1-ylethenyl)phenyl]ethenyl]naphthalene
CID 139835020
1-[(E)-2-[4-[(E)-2-naphthalen-1-ylethenyl]phenyl]ethenyl]naphthalene
CID 139196261
2-naphthalen-1-ylethenamine
CID 69243468
1-(2-bromoethenyl)naphthalene
CID 71403351
1-[2-[2-(2-phenylethenyl)phenyl]ethenyl]naphthalene
CID 71399192
4-(2-naphthalen-1-ylethenyl)-N,N-diphenylnaphthalen-1-amine
CID 76823036
tetrakis(naphthalen-1-ol);titanium
CID 18400436
naphthalene;naphthalen-1-ol
CID 174561564
9-(2-naphthalen-1-ylethenyl)anthracene
CID 630261
9-[(E)-2-naphthalen-1-ylethenyl]anthracene
CID 139205427
2-(2-naphthalen-1-ylethenyl)thiophene
CID 71318541
4-ethenylnaphthalen-1-ol;yttrium
CID 59524551

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol?
The IUPAC name of 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol (CID 139980470) is 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol.
What is the SMILES notation for 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol?
The canonical SMILES for 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol is Oc1ccc(/C=C/c2cccc3ccccc23)c2ccccc12.
What is the InChIKey of 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol?
The InChIKey is SHLOFXJVRZVJPT-OUKQBFOZSA-N. The full InChI is InChI=1S/C22H16O/c23-22-15-14-18(20-10-3-4-11-21(20)22)13-12-17-8-5-7-16-6-1-2-9-19(16)17/h1-15,23H/b13-12+.
What are the key properties of 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol?
4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol has a molecular weight of 296.37 g/mol, XLogP of 5.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-naphthalen-1-ylethenyl]naphthalen-1-ol is sourced from PubChem (CID 139980470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).