2-(3-ethenylphenyl)-1,3-dimethylbenzene

C16H16 — CID 123205650

IUPAC2-(3-ethenylphenyl)-1,3-dimethylbenzene
SMILESC=Cc1cccc(-c2c(C)cccc2C)c1
InChIInChI=1S/C16H16/c1-4-14-9-6-10-15(11-14)16-12(2)7-5-8-13(16)3/h4-11H,1H2,2-3H3
InChIKeyOGHGEOBJPYVWPV-UHFFFAOYSA-N
MW208.30 g/mol
LogP4.61
Rot. Bonds2

About 2-(3-ethenylphenyl)-1,3-dimethylbenzene

2-(3-ethenylphenyl)-1,3-dimethylbenzene (PubChem CID 123205650) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 2-(3-ethenylphenyl)-1,3-dimethylbenzene.

Molecular Properties

Compound Name2-(3-ethenylphenyl)-1,3-dimethylbenzene
PubChem CID123205650
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name2-(3-ethenylphenyl)-1,3-dimethylbenzene
SMILESC=Cc1cccc(-c2c(C)cccc2C)c1
InChIInChI=1S/C16H16/c1-4-14-9-6-10-15(11-14)16-12(2)7-5-8-13(16)3/h4-11H,1H2,2-3H3
InChIKeyOGHGEOBJPYVWPV-UHFFFAOYSA-N
XLogP4.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethenyl-3-methylbenzene
CID 7529
1,3-bis(4-ethenylphenyl)benzene;1-ethenyl-3-[4-(4-ethenylphenyl)phenyl]benzene
CID 160647587
3-(4-amino-2,6-dimethylphenyl)benzaldehyde
CID 143071394
1-ethenyl-3-[4-(4-ethylphenyl)phenyl]benzene
CID 174010619
1,3-bis(ethenyl)benzene;platinum;hexahydrochloride
CID 175502891
1-ethenyl-3-(3-propylphenyl)benzene
CID 90994074
3-ethenylaniline;hydrochloride
CID 70700938
styrene;1,2-xylene;1,3-xylene;1,4-xylene
CID 160527972
1-ethenyl-3-methylbenzene;sulfur dioxide
CID 157220077
2-chloro-4,6-bis(3-ethenylphenyl)-1,3,5-triazine
CID 162700655
1,3-dimethyl-2-(4-methyl-3-phenylphenyl)benzene
CID 168751305
5-(3-ethenylphenyl)-3-methyl-1-phenylpyrazole
CID 144542930

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethenylphenyl)-1,3-dimethylbenzene?
The IUPAC name of 2-(3-ethenylphenyl)-1,3-dimethylbenzene (CID 123205650) is 2-(3-ethenylphenyl)-1,3-dimethylbenzene.
What is the SMILES notation for 2-(3-ethenylphenyl)-1,3-dimethylbenzene?
The canonical SMILES for 2-(3-ethenylphenyl)-1,3-dimethylbenzene is C=Cc1cccc(-c2c(C)cccc2C)c1.
What is the InChIKey of 2-(3-ethenylphenyl)-1,3-dimethylbenzene?
The InChIKey is OGHGEOBJPYVWPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16/c1-4-14-9-6-10-15(11-14)16-12(2)7-5-8-13(16)3/h4-11H,1H2,2-3H3.
What are the key properties of 2-(3-ethenylphenyl)-1,3-dimethylbenzene?
2-(3-ethenylphenyl)-1,3-dimethylbenzene has a molecular weight of 208.30 g/mol, XLogP of 4.61, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethenylphenyl)-1,3-dimethylbenzene is sourced from PubChem (CID 123205650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).