1,2,4-tris(prop-1-en-2-yl)benzene

C15H18 — CID 11194966

IUPAC1,2,4-tris(prop-1-en-2-yl)benzene
SMILESC=C(C)c1ccc(C(=C)C)c(C(=C)C)c1
InChIInChI=1S/C15H18/c1-10(2)13-7-8-14(11(3)4)15(9-13)12(5)6/h7-9H,1,3,5H2,2,4,6H3
InChIKeyGPQGZUDRUAEAQL-UHFFFAOYSA-N
MW198.31 g/mol
LogP4.79
Rot. Bonds3

About 1,2,4-tris(prop-1-en-2-yl)benzene

1,2,4-tris(prop-1-en-2-yl)benzene (PubChem CID 11194966) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 1,2,4-tris(prop-1-en-2-yl)benzene.

Molecular Properties

Compound Name1,2,4-tris(prop-1-en-2-yl)benzene
PubChem CID11194966
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name1,2,4-tris(prop-1-en-2-yl)benzene
SMILESC=C(C)c1ccc(C(=C)C)c(C(=C)C)c1
InChIInChI=1S/C15H18/c1-10(2)13-7-8-14(11(3)4)15(9-13)12(5)6/h7-9H,1,3,5H2,2,4,6H3
InChIKeyGPQGZUDRUAEAQL-UHFFFAOYSA-N
XLogP4.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,4-tris(prop-1-en-2-yl)benzene?
The IUPAC name of 1,2,4-tris(prop-1-en-2-yl)benzene (CID 11194966) is 1,2,4-tris(prop-1-en-2-yl)benzene.
What is the SMILES notation for 1,2,4-tris(prop-1-en-2-yl)benzene?
The canonical SMILES for 1,2,4-tris(prop-1-en-2-yl)benzene is C=C(C)c1ccc(C(=C)C)c(C(=C)C)c1.
What is the InChIKey of 1,2,4-tris(prop-1-en-2-yl)benzene?
The InChIKey is GPQGZUDRUAEAQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-10(2)13-7-8-14(11(3)4)15(9-13)12(5)6/h7-9H,1,3,5H2,2,4,6H3.
What are the key properties of 1,2,4-tris(prop-1-en-2-yl)benzene?
1,2,4-tris(prop-1-en-2-yl)benzene has a molecular weight of 198.31 g/mol, XLogP of 4.79, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4-tris(prop-1-en-2-yl)benzene is sourced from PubChem (CID 11194966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).