3-[(E)-2-phenylethenyl]-2H-chromene

C17H14O — CID 46935147

IUPAC3-[(E)-2-phenylethenyl]-2H-chromene
SMILESC1=C(/C=C/c2ccccc2)COc2ccccc21
InChIInChI=1S/C17H14O/c1-2-6-14(7-3-1)10-11-15-12-16-8-4-5-9-17(16)18-13-15/h1-12H,13H2/b11-10+
InChIKeyVZEZYSOLWTWTEY-ZHACJKMWSA-N
MW234.30 g/mol
LogP4.18
Rot. Bonds2

About 3-[(E)-2-phenylethenyl]-2H-chromene

3-[(E)-2-phenylethenyl]-2H-chromene (PubChem CID 46935147) has the molecular formula C17H14O and a molecular weight of 234.30 g/mol. Its IUPAC name is 3-[(E)-2-phenylethenyl]-2H-chromene.

Molecular Properties

Compound Name3-[(E)-2-phenylethenyl]-2H-chromene
PubChem CID46935147
Molecular FormulaC17H14O
Molecular Weight234.30 g/mol
Exact Mass234.10
IUPAC Name3-[(E)-2-phenylethenyl]-2H-chromene
SMILESC1=C(/C=C/c2ccccc2)COc2ccccc21
InChIInChI=1S/C17H14O/c1-2-6-14(7-3-1)10-11-15-12-16-8-4-5-9-17(16)18-13-15/h1-12H,13H2/b11-10+
InChIKeyVZEZYSOLWTWTEY-ZHACJKMWSA-N
XLogP4.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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CID 123080

Frequently Asked Questions

What is the IUPAC name of 3-[(E)-2-phenylethenyl]-2H-chromene?
The IUPAC name of 3-[(E)-2-phenylethenyl]-2H-chromene (CID 46935147) is 3-[(E)-2-phenylethenyl]-2H-chromene.
What is the SMILES notation for 3-[(E)-2-phenylethenyl]-2H-chromene?
The canonical SMILES for 3-[(E)-2-phenylethenyl]-2H-chromene is C1=C(/C=C/c2ccccc2)COc2ccccc21.
What is the InChIKey of 3-[(E)-2-phenylethenyl]-2H-chromene?
The InChIKey is VZEZYSOLWTWTEY-ZHACJKMWSA-N. The full InChI is InChI=1S/C17H14O/c1-2-6-14(7-3-1)10-11-15-12-16-8-4-5-9-17(16)18-13-15/h1-12H,13H2/b11-10+.
What are the key properties of 3-[(E)-2-phenylethenyl]-2H-chromene?
3-[(E)-2-phenylethenyl]-2H-chromene has a molecular weight of 234.30 g/mol, XLogP of 4.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-2-phenylethenyl]-2H-chromene is sourced from PubChem (CID 46935147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).