1,2-bis(ethenyl)-4-methylbenzene;methoxymethane

C13H18O — CID 142804443

IUPAC1,2-bis(ethenyl)-4-methylbenzene;methoxymethane
SMILESC=Cc1ccc(C)cc1C=C.COC
InChIInChI=1S/C11H12.C2H6O/c1-4-10-7-6-9(3)8-11(10)5-2;1-3-2/h4-8H,1-2H2,3H3;1-2H3
InChIKeyGFQIXTWCMBMGJH-UHFFFAOYSA-N
MW190.29 g/mol
LogP3.54
Rot. Bonds2

About 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane

1,2-bis(ethenyl)-4-methylbenzene;methoxymethane (PubChem CID 142804443) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane.

Molecular Properties

Compound Name1,2-bis(ethenyl)-4-methylbenzene;methoxymethane
PubChem CID142804443
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name1,2-bis(ethenyl)-4-methylbenzene;methoxymethane
SMILESC=Cc1ccc(C)cc1C=C.COC
InChIInChI=1S/C11H12.C2H6O/c1-4-10-7-6-9(3)8-11(10)5-2;1-3-2/h4-8H,1-2H2,3H3;1-2H3
InChIKeyGFQIXTWCMBMGJH-UHFFFAOYSA-N
XLogP3.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-bis(ethenyl)-4-methylbenzene;ethane;prop-1-ene
CID 143109354
1,2-bis(ethenyl)-4-methylbenzene;ethane;methane;prop-1-ene
CID 143109411
ethane;2-ethenyl-4-methyl-1-[(Z)-prop-1-enyl]benzene
CID 172609650
1-ethenyl-2,4-dimethylbenzene
CID 157285903
ethane;1-ethenyl-4-methyl-2-[(Z)-prop-1-enyl]benzene;methane
CID 143188972
1-ethenyl-2-iodo-4-methylbenzene
CID 139713418
1-chloro-2-ethenyl-4-methylbenzene
CID 19377357
2-ethenyl-1,7-dimethylnaphthalene
CID 142881924
1-ethenyl-4-methyl-2-prop-2-enoxybenzene
CID 59606813
1-ethenyl-2-ethyl-4-methylbenzene
CID 18626822
2-ethenyl-4-methyl-1-(3-methylpent-1-enyl)benzene
CID 123226279
(2-ethenyl-5-methylphenyl)hydrazine
CID 89194075

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane?
The IUPAC name of 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane (CID 142804443) is 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane.
What is the SMILES notation for 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane?
The canonical SMILES for 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane is C=Cc1ccc(C)cc1C=C.COC.
What is the InChIKey of 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane?
The InChIKey is GFQIXTWCMBMGJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12.C2H6O/c1-4-10-7-6-9(3)8-11(10)5-2;1-3-2/h4-8H,1-2H2,3H3;1-2H3.
What are the key properties of 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane?
1,2-bis(ethenyl)-4-methylbenzene;methoxymethane has a molecular weight of 190.29 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(ethenyl)-4-methylbenzene;methoxymethane is sourced from PubChem (CID 142804443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).