(2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene

C24H16 — CID 5378633

IUPAC(2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene
SMILESc1cc2c3c(cccc3c1)/C(=C1\Cc3cccc4cccc1c34)C2
InChIInChI=1S/C24H16/c1-5-15-7-3-11-19-21(13-17(9-1)23(15)19)22-14-18-10-2-6-16-8-4-12-20(22)24(16)18/h1-12H,13-14H2/b22-21+
InChIKeySBXNBQKTWHZZGA-QURGRASLSA-N
MW304.39 g/mol
LogP6.02
Rot. Bonds

About (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene

(2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene (PubChem CID 5378633) has the molecular formula C24H16 and a molecular weight of 304.39 g/mol. Its IUPAC name is (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene.

Molecular Properties

Compound Name(2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene
PubChem CID5378633
Molecular FormulaC24H16
Molecular Weight304.39 g/mol
Exact Mass304.13
IUPAC Name(2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene
SMILESc1cc2c3c(cccc3c1)/C(=C1\Cc3cccc4cccc1c34)C2
InChIInChI=1S/C24H16/c1-5-15-7-3-11-19-21(13-17(9-1)23(15)19)22-14-18-10-2-6-16-8-4-12-20(22)24(16)18/h1-12H,13-14H2/b22-21+
InChIKeySBXNBQKTWHZZGA-QURGRASLSA-N
XLogP6.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.39
LogP ≤ 56.02
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 (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene?
The IUPAC name of (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene (CID 5378633) is (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene.
What is the SMILES notation for (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene?
The canonical SMILES for (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene is c1cc2c3c(cccc3c1)/C(=C1\Cc3cccc4cccc1c34)C2.
What is the InChIKey of (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene?
The InChIKey is SBXNBQKTWHZZGA-QURGRASLSA-N. The full InChI is InChI=1S/C24H16/c1-5-15-7-3-11-19-21(13-17(9-1)23(15)19)22-14-18-10-2-6-16-8-4-12-20(22)24(16)18/h1-12H,13-14H2/b22-21+.
What are the key properties of (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene?
(2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene has a molecular weight of 304.39 g/mol, XLogP of 6.02, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-(2H-acenaphthylen-1-ylidene)-1H-acenaphthylene is sourced from PubChem (CID 5378633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).