1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene

C23H18 — CID 174368476

IUPAC1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene
SMILESC1=CC(c2ccccc2)=C(c2ccccc2-c2ccccc2)C1
InChIInChI=1S/C23H18/c1-3-10-18(11-4-1)20-14-7-8-15-22(20)23-17-9-16-21(23)19-12-5-2-6-13-19/h1-16H,17H2
InChIKeyYHDZMVGLOXNUGO-UHFFFAOYSA-N
MW294.40 g/mol
LogP6.22
Rot. Bonds3

About 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene

1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene (PubChem CID 174368476) has the molecular formula C23H18 and a molecular weight of 294.40 g/mol. Its IUPAC name is 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene.

Molecular Properties

Compound Name1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene
PubChem CID174368476
Molecular FormulaC23H18
Molecular Weight294.40 g/mol
Exact Mass294.14
IUPAC Name1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene
SMILESC1=CC(c2ccccc2)=C(c2ccccc2-c2ccccc2)C1
InChIInChI=1S/C23H18/c1-3-10-18(11-4-1)20-14-7-8-15-22(20)23-17-9-16-21(23)19-12-5-2-6-13-19/h1-16H,17H2
InChIKeyYHDZMVGLOXNUGO-UHFFFAOYSA-N
XLogP6.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.40
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-3-[2-(2-methyl-5-phenylthiophen-3-yl)cyclopenta-1,3-dien-1-yl]-5-phenylthiophene
CID 59420001
methane;1-phenyl-2-(2-phenylphenyl)benzene
CID 144789864
(2-tert-butylcyclopenta-1,4-dien-1-yl)benzene
CID 102207082
chloro-(2-phenylcyclopenta-1,3-dien-1-yl)phosphane
CID 137227869
1,2-diphenylcycloocta-1,3-diene
CID 54091831
6-ethyl-4-phenyl-1,5-dihydropentalene
CID 15636400
CID 69011285
CID 69011285
(2,6-diphenylphenyl)-(2,6-diphenylphenyl)plumbanylidynelead
CID 177444847
4,7-diphenyl-1H-indene
CID 14940861
trimethyl-(2-phenylcyclopenta-1,4-dien-1-yl)silane
CID 159054815
(2-ethylcyclopenta-1,3-dien-1-yl)benzene
CID 139667599
1-methyl-2-[4-(2-phenylphenyl)phenyl]benzene
CID 58390061

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene?
The IUPAC name of 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene (CID 174368476) is 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene.
What is the SMILES notation for 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene?
The canonical SMILES for 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene is C1=CC(c2ccccc2)=C(c2ccccc2-c2ccccc2)C1.
What is the InChIKey of 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene?
The InChIKey is YHDZMVGLOXNUGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18/c1-3-10-18(11-4-1)20-14-7-8-15-22(20)23-17-9-16-21(23)19-12-5-2-6-13-19/h1-16H,17H2.
What are the key properties of 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene?
1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene has a molecular weight of 294.40 g/mol, XLogP of 6.22, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(2-phenylcyclopenta-1,3-dien-1-yl)benzene is sourced from PubChem (CID 174368476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).