2-[(Z)-2-anthracen-2-ylethenyl]anthracene

C30H20 — CID 101144533

IUPAC2-[(Z)-2-anthracen-2-ylethenyl]anthracene
SMILESC(=C\c1ccc2cc3ccccc3cc2c1)\c1ccc2cc3ccccc3cc2c1
InChIInChI=1S/C30H20/c1-3-7-25-19-29-15-21(11-13-27(29)17-23(25)5-1)9-10-22-12-14-28-18-24-6-2-4-8-26(24)20-30(28)16-22/h1-20H/b10-9-
InChIKeyHEYQIJJHFKAOTR-KTKRTIGZSA-N
MW380.49 g/mol
LogP8.47
Rot. Bonds2

About 2-[(Z)-2-anthracen-2-ylethenyl]anthracene

2-[(Z)-2-anthracen-2-ylethenyl]anthracene (PubChem CID 101144533) has the molecular formula C30H20 and a molecular weight of 380.49 g/mol. Its IUPAC name is 2-[(Z)-2-anthracen-2-ylethenyl]anthracene.

Molecular Properties

Compound Name2-[(Z)-2-anthracen-2-ylethenyl]anthracene
PubChem CID101144533
Molecular FormulaC30H20
Molecular Weight380.49 g/mol
Exact Mass380.16
IUPAC Name2-[(Z)-2-anthracen-2-ylethenyl]anthracene
SMILESC(=C\c1ccc2cc3ccccc3cc2c1)\c1ccc2cc3ccccc3cc2c1
InChIInChI=1S/C30H20/c1-3-7-25-19-29-15-21(11-13-27(29)17-23(25)5-1)9-10-22-12-14-28-18-24-6-2-4-8-26(24)20-30(28)16-22/h1-20H/b10-9-
InChIKeyHEYQIJJHFKAOTR-KTKRTIGZSA-N
XLogP8.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.49
LogP ≤ 58.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[4-(2-tetracen-2-ylethenyl)phenyl]ethenyl]tetracene
CID 76589902
2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 20801533
2-[2-[4-[2-[4-(2-anthracen-2-ylethenyl)phenyl]propan-2-yl]phenyl]ethenyl]anthracene
CID 72543257
4-[(E)-2-anthracen-2-ylethenyl]-N,N-diphenylaniline
CID 20801910
7,17-bis(2-tetracen-2-ylethenyl)-6,18-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1(20),2,4,7,9,11,13,15(19),16-nonaene
CID 76589926
2-naphthalen-2-ylethenol
CID 67195423
2-[(E)-2-[4-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]selanylphenyl]ethenyl]naphthalene
CID 59156066
2-(2-naphthalen-2-ylethynyl)-6-[(E)-2-[6-(2-naphthalen-2-ylethynyl)naphthalen-2-yl]ethenyl]naphthalene
CID 59413225
6-[(E)-2-[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]ethenyl]-N,N-dinaphthalen-2-ylnaphthalen-2-amine
CID 58667641
naphthalen-2-yl-[6-[2-[6-(naphthalen-2-yldiazenyl)naphthalen-2-yl]ethenyl]naphthalen-2-yl]diazene
CID 72565674
tris[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]phosphane
CID 58942119
2-[(E)-2-[4-[(E)-2-anthracen-2-ylethenyl]phenyl]ethenyl]anthracene;2-[(E)-2-[4-[(E)-2-dibenzothiophen-2-ylethenyl]phenyl]ethenyl]dibenzothiophene
CID 143526425

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-anthracen-2-ylethenyl]anthracene?
The IUPAC name of 2-[(Z)-2-anthracen-2-ylethenyl]anthracene (CID 101144533) is 2-[(Z)-2-anthracen-2-ylethenyl]anthracene.
What is the SMILES notation for 2-[(Z)-2-anthracen-2-ylethenyl]anthracene?
The canonical SMILES for 2-[(Z)-2-anthracen-2-ylethenyl]anthracene is C(=C\c1ccc2cc3ccccc3cc2c1)\c1ccc2cc3ccccc3cc2c1.
What is the InChIKey of 2-[(Z)-2-anthracen-2-ylethenyl]anthracene?
The InChIKey is HEYQIJJHFKAOTR-KTKRTIGZSA-N. The full InChI is InChI=1S/C30H20/c1-3-7-25-19-29-15-21(11-13-27(29)17-23(25)5-1)9-10-22-12-14-28-18-24-6-2-4-8-26(24)20-30(28)16-22/h1-20H/b10-9-.
What are the key properties of 2-[(Z)-2-anthracen-2-ylethenyl]anthracene?
2-[(Z)-2-anthracen-2-ylethenyl]anthracene has a molecular weight of 380.49 g/mol, XLogP of 8.47, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-anthracen-2-ylethenyl]anthracene is sourced from PubChem (CID 101144533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).