1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene

C22H20 — CID 174010619

IUPAC1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene
SMILESC=Cc1cccc(-c2ccc(-c3ccc(CC)cc3)cc2)c1
InChIInChI=1S/C22H20/c1-3-17-8-10-19(11-9-17)20-12-14-21(15-13-20)22-7-5-6-18(4-2)16-22/h4-16H,2-3H2,1H3
InChIKeyKZSXRLIBLSXFQM-UHFFFAOYSA-N
MW284.40 g/mol
LogP6.23
Rot. Bonds4

About 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene

1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene (PubChem CID 174010619) has the molecular formula C22H20 and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene.

Molecular Properties

Compound Name1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene
PubChem CID174010619
Molecular FormulaC22H20
Molecular Weight284.40 g/mol
Exact Mass284.16
IUPAC Name1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene
SMILESC=Cc1cccc(-c2ccc(-c3ccc(CC)cc3)cc2)c1
InChIInChI=1S/C22H20/c1-3-17-8-10-19(11-9-17)20-12-14-21(15-13-20)22-7-5-6-18(4-2)16-22/h4-16H,2-3H2,1H3
InChIKeyKZSXRLIBLSXFQM-UHFFFAOYSA-N
XLogP6.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.40
LogP ≤ 56.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,3-bis(4-ethenylphenyl)benzene;1-ethenyl-3-[4-(4-ethenylphenyl)phenyl]benzene
CID 160647587
1-ethenyl-3-(3-propylphenyl)benzene
CID 90994074
1,2-bis(ethenyl)benzene;1,3-bis(ethenyl)benzene;1,4-bis(ethenyl)benzene;1-ethenyl-4-ethylbenzene
CID 137319863
1,2-bis(ethenyl)-4-(4-ethylphenyl)benzene
CID 156753876
1-ethyl-4-(3-methylphenyl)benzene
CID 12641077
N-(4-ethenylphenyl)-4-ethyl-N-[4-[3-[3-[3-(3-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]aniline
CID 59800861
3-[3-(3-ethenylphenyl)phenyl]-N-[4-[4-(N-[3-[3-(3-ethenylphenyl)phenyl]phenyl]anilino)phenyl]phenyl]-N-phenylaniline
CID 58113558
1-(4-ethylphenyl)-3,5-diphenylbenzene
CID 123998830
ethylbenzene;methane;styrene;hydrate
CID 169425917
bicyclo[3.1.0]hexa-1(6),2,4-triene;but-1-ene
CID 23063595
1-ethyl-4-(3-methylsulfanylphenyl)benzene
CID 139494448
2-(3-ethenylphenyl)-5-[4-(3-ethenylphenyl)phenyl]-1,3,4-oxadiazole
CID 59307432

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene?
The IUPAC name of 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene (CID 174010619) is 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene.
What is the SMILES notation for 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene?
The canonical SMILES for 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene is C=Cc1cccc(-c2ccc(-c3ccc(CC)cc3)cc2)c1.
What is the InChIKey of 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene?
The InChIKey is KZSXRLIBLSXFQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20/c1-3-17-8-10-19(11-9-17)20-12-14-21(15-13-20)22-7-5-6-18(4-2)16-22/h4-16H,2-3H2,1H3.
What are the key properties of 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene?
1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene has a molecular weight of 284.40 g/mol, XLogP of 6.23, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene is sourced from PubChem (CID 174010619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).