2,3-bis(prop-1-en-2-yl)phenol

C12H14O — CID 68747547

IUPAC2,3-bis(prop-1-en-2-yl)phenol
SMILESC=C(C)c1cccc(O)c1C(=C)C
InChIInChI=1S/C12H14O/c1-8(2)10-6-5-7-11(13)12(10)9(3)4/h5-7,13H,1,3H2,2,4H3
InChIKeyDPSPKGIWPYBTOM-UHFFFAOYSA-N
MW174.24 g/mol
LogP3.46
Rot. Bonds2

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

2,3-bis(prop-1-en-2-yl)phenol (PubChem CID 68747547) has the molecular formula C12H14O and a molecular weight of 174.24 g/mol. Its IUPAC name is 2,3-bis(prop-1-en-2-yl)phenol.

Molecular Properties

Compound Name2,3-bis(prop-1-en-2-yl)phenol
PubChem CID68747547
Molecular FormulaC12H14O
Molecular Weight174.24 g/mol
Exact Mass174.10
IUPAC Name2,3-bis(prop-1-en-2-yl)phenol
SMILESC=C(C)c1cccc(O)c1C(=C)C
InChIInChI=1S/C12H14O/c1-8(2)10-6-5-7-11(13)12(10)9(3)4/h5-7,13H,1,3H2,2,4H3
InChIKeyDPSPKGIWPYBTOM-UHFFFAOYSA-N
XLogP3.46
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(prop-1-en-2-yl)phenol?
The IUPAC name of 2,3-bis(prop-1-en-2-yl)phenol (CID 68747547) is 2,3-bis(prop-1-en-2-yl)phenol.
What is the SMILES notation for 2,3-bis(prop-1-en-2-yl)phenol?
The canonical SMILES for 2,3-bis(prop-1-en-2-yl)phenol is C=C(C)c1cccc(O)c1C(=C)C.
What is the InChIKey of 2,3-bis(prop-1-en-2-yl)phenol?
The InChIKey is DPSPKGIWPYBTOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O/c1-8(2)10-6-5-7-11(13)12(10)9(3)4/h5-7,13H,1,3H2,2,4H3.
What are the key properties of 2,3-bis(prop-1-en-2-yl)phenol?
2,3-bis(prop-1-en-2-yl)phenol has a molecular weight of 174.24 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(prop-1-en-2-yl)phenol is sourced from PubChem (CID 68747547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).