2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene

C15H20 — CID 141209236

IUPAC2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene
SMILESC=C(C)c1cccc(C(=C)C)c1C(C)C
InChIInChI=1S/C15H20/c1-10(2)13-8-7-9-14(11(3)4)15(13)12(5)6/h7-9,12H,1,3H2,2,4-6H3
InChIKeyUWOQYUJMJBJVJE-UHFFFAOYSA-N
MW200.32 g/mol
LogP4.88
Rot. Bonds3

About 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene

2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene (PubChem CID 141209236) has the molecular formula C15H20 and a molecular weight of 200.32 g/mol. Its IUPAC name is 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene.

Molecular Properties

Compound Name2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene
PubChem CID141209236
Molecular FormulaC15H20
Molecular Weight200.32 g/mol
Exact Mass200.16
IUPAC Name2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene
SMILESC=C(C)c1cccc(C(=C)C)c1C(C)C
InChIInChI=1S/C15H20/c1-10(2)13-8-7-9-14(11(3)4)15(13)12(5)6/h7-9,12H,1,3H2,2,4-6H3
InChIKeyUWOQYUJMJBJVJE-UHFFFAOYSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene?
The IUPAC name of 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene (CID 141209236) is 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene.
What is the SMILES notation for 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene?
The canonical SMILES for 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene is C=C(C)c1cccc(C(=C)C)c1C(C)C.
What is the InChIKey of 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene?
The InChIKey is UWOQYUJMJBJVJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20/c1-10(2)13-8-7-9-14(11(3)4)15(13)12(5)6/h7-9,12H,1,3H2,2,4-6H3.
What are the key properties of 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene?
2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene has a molecular weight of 200.32 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-1,3-bis(prop-1-en-2-yl)benzene is sourced from PubChem (CID 141209236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).