2,3,6-tris(prop-1-en-2-yl)phenol

C15H18O — CID 101292776

IUPAC2,3,6-tris(prop-1-en-2-yl)phenol
SMILESC=C(C)c1ccc(C(=C)C)c(C(=C)C)c1O
InChIInChI=1S/C15H18O/c1-9(2)12-7-8-13(10(3)4)15(16)14(12)11(5)6/h7-8,16H,1,3,5H2,2,4,6H3
InChIKeyNSSCVYDZGWHQQL-UHFFFAOYSA-N
MW214.31 g/mol
LogP4.49
Rot. Bonds3

About 2,3,6-tris(prop-1-en-2-yl)phenol

2,3,6-tris(prop-1-en-2-yl)phenol (PubChem CID 101292776) has the molecular formula C15H18O and a molecular weight of 214.31 g/mol. Its IUPAC name is 2,3,6-tris(prop-1-en-2-yl)phenol.

Molecular Properties

Compound Name2,3,6-tris(prop-1-en-2-yl)phenol
PubChem CID101292776
Molecular FormulaC15H18O
Molecular Weight214.31 g/mol
Exact Mass214.14
IUPAC Name2,3,6-tris(prop-1-en-2-yl)phenol
SMILESC=C(C)c1ccc(C(=C)C)c(C(=C)C)c1O
InChIInChI=1S/C15H18O/c1-9(2)12-7-8-13(10(3)4)15(16)14(12)11(5)6/h7-8,16H,1,3,5H2,2,4,6H3
InChIKeyNSSCVYDZGWHQQL-UHFFFAOYSA-N
XLogP4.49
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,3,4-tetrakis(prop-1-en-2-yl)benzene
CID 19429816
2,3-bis(prop-1-en-2-yl)phenol
CID 68747547
2-hydroxy-3-prop-1-en-2-ylbenzoic acid
CID 11423898
2,3-bis(prop-1-en-2-yl)terephthalate
CID 22222062
2-amino-4-prop-1-en-2-ylpyridin-3-ol
CID 142250689
actinium;2-prop-1-en-2-ylphenol
CID 20669246
4-[3,4-bis(prop-1-en-2-yl)phenyl]-1,2-bis(prop-1-en-2-yl)benzene
CID 176568889
1,2-bis(prop-1-en-2-yl)benzene;hydrogen peroxide
CID 175029396
lithium 1,2-bis(prop-1-en-2-yl)benzene
CID 22717015
2-phenyl-6-prop-1-en-2-ylphenol
CID 154380547
1,2,3-tris(prop-1-en-2-yl)benzene diisocyanate
CID 23452776
actinium;3-methyl-4-prop-1-en-2-ylphenol
CID 20669254

Frequently Asked Questions

What is the IUPAC name of 2,3,6-tris(prop-1-en-2-yl)phenol?
The IUPAC name of 2,3,6-tris(prop-1-en-2-yl)phenol (CID 101292776) is 2,3,6-tris(prop-1-en-2-yl)phenol.
What is the SMILES notation for 2,3,6-tris(prop-1-en-2-yl)phenol?
The canonical SMILES for 2,3,6-tris(prop-1-en-2-yl)phenol is C=C(C)c1ccc(C(=C)C)c(C(=C)C)c1O.
What is the InChIKey of 2,3,6-tris(prop-1-en-2-yl)phenol?
The InChIKey is NSSCVYDZGWHQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O/c1-9(2)12-7-8-13(10(3)4)15(16)14(12)11(5)6/h7-8,16H,1,3,5H2,2,4,6H3.
What are the key properties of 2,3,6-tris(prop-1-en-2-yl)phenol?
2,3,6-tris(prop-1-en-2-yl)phenol has a molecular weight of 214.31 g/mol, XLogP of 4.49, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,6-tris(prop-1-en-2-yl)phenol is sourced from PubChem (CID 101292776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).