2-ethenyl-4-phenylbenzene-1,3-diol

C14H12O2 — CID 151131701

IUPAC2-ethenyl-4-phenylbenzene-1,3-diol
SMILESC=Cc1c(O)ccc(-c2ccccc2)c1O
InChIInChI=1S/C14H12O2/c1-2-11-13(15)9-8-12(14(11)16)10-6-4-3-5-7-10/h2-9,15-16H,1H2
InChIKeyMUIZHEYZNQFDDQ-UHFFFAOYSA-N
MW212.25 g/mol
LogP3.41
Rot. Bonds2

About 2-ethenyl-4-phenylbenzene-1,3-diol

2-ethenyl-4-phenylbenzene-1,3-diol (PubChem CID 151131701) has the molecular formula C14H12O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 2-ethenyl-4-phenylbenzene-1,3-diol.

Molecular Properties

Compound Name2-ethenyl-4-phenylbenzene-1,3-diol
PubChem CID151131701
Molecular FormulaC14H12O2
Molecular Weight212.25 g/mol
Exact Mass212.08
IUPAC Name2-ethenyl-4-phenylbenzene-1,3-diol
SMILESC=Cc1c(O)ccc(-c2ccccc2)c1O
InChIInChI=1S/C14H12O2/c1-2-11-13(15)9-8-12(14(11)16)10-6-4-3-5-7-10/h2-9,15-16H,1H2
InChIKeyMUIZHEYZNQFDDQ-UHFFFAOYSA-N
XLogP3.41
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-4-phenylbenzene-1,3-diol?
The IUPAC name of 2-ethenyl-4-phenylbenzene-1,3-diol (CID 151131701) is 2-ethenyl-4-phenylbenzene-1,3-diol.
What is the SMILES notation for 2-ethenyl-4-phenylbenzene-1,3-diol?
The canonical SMILES for 2-ethenyl-4-phenylbenzene-1,3-diol is C=Cc1c(O)ccc(-c2ccccc2)c1O.
What is the InChIKey of 2-ethenyl-4-phenylbenzene-1,3-diol?
The InChIKey is MUIZHEYZNQFDDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O2/c1-2-11-13(15)9-8-12(14(11)16)10-6-4-3-5-7-10/h2-9,15-16H,1H2.
What are the key properties of 2-ethenyl-4-phenylbenzene-1,3-diol?
2-ethenyl-4-phenylbenzene-1,3-diol has a molecular weight of 212.25 g/mol, XLogP of 3.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4-phenylbenzene-1,3-diol is sourced from PubChem (CID 151131701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).