styrene;1,2,2-triphenylethenylbenzene

C34H28 — CID 161183519

IUPACstyrene;1,2,2-triphenylethenylbenzene
SMILESC=Cc1ccccc1.c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H20.C8H8/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-2-8-6-4-3-5-7-8/h1-20H;2-7H,1H2
InChIKeyUSUBXIPMLUJVLC-UHFFFAOYSA-N
MW436.60 g/mol
LogP9.02
Rot. Bonds5

About styrene;1,2,2-triphenylethenylbenzene

styrene;1,2,2-triphenylethenylbenzene (PubChem CID 161183519) has the molecular formula C34H28 and a molecular weight of 436.60 g/mol. Its IUPAC name is styrene;1,2,2-triphenylethenylbenzene.

Molecular Properties

Compound Namestyrene;1,2,2-triphenylethenylbenzene
PubChem CID161183519
Molecular FormulaC34H28
Molecular Weight436.60 g/mol
Exact Mass436.22
IUPAC Namestyrene;1,2,2-triphenylethenylbenzene
SMILESC=Cc1ccccc1.c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H20.C8H8/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-2-8-6-4-3-5-7-8/h1-20H;2-7H,1H2
InChIKeyUSUBXIPMLUJVLC-UHFFFAOYSA-N
XLogP9.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.60
LogP ≤ 59.02
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

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CID 18314782
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styrene;tetrahydrofluoride
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cadmium;styrene
CID 158944156
bis(prop-1-en-2-ylbenzene);styrene
CID 157311042
benzene;ethane;styrene
CID 21219610
magnesium;styrene;dibromide
CID 170339005
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1-phenylethanone;styrene
CID 19811140
phenol;styrene
CID 160675765

Frequently Asked Questions

What is the IUPAC name of styrene;1,2,2-triphenylethenylbenzene?
The IUPAC name of styrene;1,2,2-triphenylethenylbenzene (CID 161183519) is styrene;1,2,2-triphenylethenylbenzene.
What is the SMILES notation for styrene;1,2,2-triphenylethenylbenzene?
The canonical SMILES for styrene;1,2,2-triphenylethenylbenzene is C=Cc1ccccc1.c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of styrene;1,2,2-triphenylethenylbenzene?
The InChIKey is USUBXIPMLUJVLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20.C8H8/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-2-8-6-4-3-5-7-8/h1-20H;2-7H,1H2.
What are the key properties of styrene;1,2,2-triphenylethenylbenzene?
styrene;1,2,2-triphenylethenylbenzene has a molecular weight of 436.60 g/mol, XLogP of 9.02, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for styrene;1,2,2-triphenylethenylbenzene is sourced from PubChem (CID 161183519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).