1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene

C24H17Br — CID 144810159

IUPAC1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene
SMILESBrc1ccc(/C=C(/c2ccccc2)c2cccc3ccccc23)cc1
InChIInChI=1S/C24H17Br/c25-21-15-13-18(14-16-21)17-24(20-7-2-1-3-8-20)23-12-6-10-19-9-4-5-11-22(19)23/h1-17H/b24-17-
InChIKeyRKCAAJDHVYCSRA-ULJHMMPZSA-N
MW385.30 g/mol
LogP7.19
Rot. Bonds3

About 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene

1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene (PubChem CID 144810159) has the molecular formula C24H17Br and a molecular weight of 385.30 g/mol. Its IUPAC name is 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene.

Molecular Properties

Compound Name1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene
PubChem CID144810159
Molecular FormulaC24H17Br
Molecular Weight385.30 g/mol
Exact Mass384.05
IUPAC Name1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene
SMILESBrc1ccc(/C=C(/c2ccccc2)c2cccc3ccccc23)cc1
InChIInChI=1S/C24H17Br/c25-21-15-13-18(14-16-21)17-24(20-7-2-1-3-8-20)23-12-6-10-19-9-4-5-11-22(19)23/h1-17H/b24-17-
InChIKeyRKCAAJDHVYCSRA-ULJHMMPZSA-N
XLogP7.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.30
LogP ≤ 57.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene?
The IUPAC name of 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene (CID 144810159) is 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene.
What is the SMILES notation for 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene?
The canonical SMILES for 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene is Brc1ccc(/C=C(/c2ccccc2)c2cccc3ccccc23)cc1.
What is the InChIKey of 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene?
The InChIKey is RKCAAJDHVYCSRA-ULJHMMPZSA-N. The full InChI is InChI=1S/C24H17Br/c25-21-15-13-18(14-16-21)17-24(20-7-2-1-3-8-20)23-12-6-10-19-9-4-5-11-22(19)23/h1-17H/b24-17-.
What are the key properties of 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene?
1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene has a molecular weight of 385.30 g/mol, XLogP of 7.19, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-2-(4-bromophenyl)-1-phenylethenyl]naphthalene is sourced from PubChem (CID 144810159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).