4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol

C16H16O2 — CID 12564793

IUPAC4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol
SMILESCOc1ccc(O)c(C/C=C/c2ccccc2)c1
InChIInChI=1S/C16H16O2/c1-18-15-10-11-16(17)14(12-15)9-5-8-13-6-3-2-4-7-13/h2-8,10-12,17H,9H2,1H3/b8-5+
InChIKeyANOINEJMMUGSIY-VMPITWQZSA-N
MW240.30 g/mol
LogP3.66
Rot. Bonds4

About 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol

4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol (PubChem CID 12564793) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol.

Molecular Properties

Compound Name4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol
PubChem CID12564793
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol
SMILESCOc1ccc(O)c(C/C=C/c2ccccc2)c1
InChIInChI=1S/C16H16O2/c1-18-15-10-11-16(17)14(12-15)9-5-8-13-6-3-2-4-7-13/h2-8,10-12,17H,9H2,1H3/b8-5+
InChIKeyANOINEJMMUGSIY-VMPITWQZSA-N
XLogP3.66
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol?
The IUPAC name of 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol (CID 12564793) is 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol.
What is the SMILES notation for 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol?
The canonical SMILES for 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol is COc1ccc(O)c(C/C=C/c2ccccc2)c1.
What is the InChIKey of 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol?
The InChIKey is ANOINEJMMUGSIY-VMPITWQZSA-N. The full InChI is InChI=1S/C16H16O2/c1-18-15-10-11-16(17)14(12-15)9-5-8-13-6-3-2-4-7-13/h2-8,10-12,17H,9H2,1H3/b8-5+.
What are the key properties of 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol?
4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol has a molecular weight of 240.30 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[(E)-3-phenylprop-2-enyl]phenol is sourced from PubChem (CID 12564793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).