9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene

C34H24 — CID 90899985

IUPAC9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene
SMILESC=Cc1cccc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c1C=C
InChIInChI=1S/C34H24/c1-3-23-14-11-21-27(25(23)4-2)33-29-17-7-9-19-31(29)34(32-20-10-8-18-30(32)33)28-22-12-15-24-13-5-6-16-26(24)28/h3-22H,1-2H2
InChIKeyMMYCICYQODRNTR-UHFFFAOYSA-N
MW432.57 g/mol
LogP9.77
Rot. Bonds4

About 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene

9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene (PubChem CID 90899985) has the molecular formula C34H24 and a molecular weight of 432.57 g/mol. Its IUPAC name is 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene.

Molecular Properties

Compound Name9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene
PubChem CID90899985
Molecular FormulaC34H24
Molecular Weight432.57 g/mol
Exact Mass432.19
IUPAC Name9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene
SMILESC=Cc1cccc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c1C=C
InChIInChI=1S/C34H24/c1-3-23-14-11-21-27(25(23)4-2)33-29-17-7-9-19-31(29)34(32-20-10-8-18-30(32)33)28-22-12-15-24-13-5-6-16-26(24)28/h3-22H,1-2H2
InChIKeyMMYCICYQODRNTR-UHFFFAOYSA-N
XLogP9.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.57
LogP ≤ 59.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

1-[2,3,5,6-tetrakis(ethenyl)phenyl]naphthalene
CID 123541767
2-[10-[2,3-bis(ethenyl)phenyl]-9-naphthalen-1-ylanthracen-2-yl]-6-phenylpyridine
CID 88589712
1-[2,3-bis(ethenyl)-4-naphthalen-2-ylphenyl]-4-[2,3-bis(ethenyl)phenyl]-2,3-bis(ethenyl)naphthalene
CID 143856218
9-naphthalen-1-yl-10-[4-[4-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]naphthalen-1-yl]anthracene
CID 59861499
1-ethenylnaphthalene;propane
CID 90732485
1,9,10-trinaphthalen-1-ylanthracene
CID 58322859
9,10-bis(2-naphthalen-1-ylphenyl)anthracene
CID 22138017
1-ethenylnaphthalene;3-penta-1,4-dien-3-yloxypenta-1,4-diene
CID 67613878
ethenyl-dimethyl-(10-naphthalen-1-ylanthracen-9-yl)silane
CID 123394988
10-naphthalen-1-ylanthracen-9-amine
CID 126729232
9-naphthalen-1-yl-10-(10-naphthalen-1-ylanthracen-9-yl)oxyanthracene
CID 90290732
1,2-bis(ethenyl)-3-(2-methylphenyl)benzene
CID 143516768

Frequently Asked Questions

What is the IUPAC name of 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene?
The IUPAC name of 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene (CID 90899985) is 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene.
What is the SMILES notation for 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene?
The canonical SMILES for 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene is C=Cc1cccc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c1C=C.
What is the InChIKey of 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene?
The InChIKey is MMYCICYQODRNTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24/c1-3-23-14-11-21-27(25(23)4-2)33-29-17-7-9-19-31(29)34(32-20-10-8-18-30(32)33)28-22-12-15-24-13-5-6-16-26(24)28/h3-22H,1-2H2.
What are the key properties of 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene?
9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene has a molecular weight of 432.57 g/mol, XLogP of 9.77, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2,3-bis(ethenyl)phenyl]-10-naphthalen-1-ylanthracene is sourced from PubChem (CID 90899985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).