6-methyl-2,3-bis(2-phenylethenyl)phenol

C23H20O — CID 54059537

IUPAC6-methyl-2,3-bis(2-phenylethenyl)phenol
SMILESCc1ccc(C=Cc2ccccc2)c(C=Cc2ccccc2)c1O
InChIInChI=1S/C23H20O/c1-18-12-15-21(16-13-19-8-4-2-5-9-19)22(23(18)24)17-14-20-10-6-3-7-11-20/h2-17,24H,1H3
InChIKeyLYRIGBYMQMDVTF-UHFFFAOYSA-N
MW312.41 g/mol
LogP6.04
Rot. Bonds4

About 6-methyl-2,3-bis(2-phenylethenyl)phenol

6-methyl-2,3-bis(2-phenylethenyl)phenol (PubChem CID 54059537) has the molecular formula C23H20O and a molecular weight of 312.41 g/mol. Its IUPAC name is 6-methyl-2,3-bis(2-phenylethenyl)phenol.

Molecular Properties

Compound Name6-methyl-2,3-bis(2-phenylethenyl)phenol
PubChem CID54059537
Molecular FormulaC23H20O
Molecular Weight312.41 g/mol
Exact Mass312.15
IUPAC Name6-methyl-2,3-bis(2-phenylethenyl)phenol
SMILESCc1ccc(C=Cc2ccccc2)c(C=Cc2ccccc2)c1O
InChIInChI=1S/C23H20O/c1-18-12-15-21(16-13-19-8-4-2-5-9-19)22(23(18)24)17-14-20-10-6-3-7-11-20/h2-17,24H,1H3
InChIKeyLYRIGBYMQMDVTF-UHFFFAOYSA-N
XLogP6.04
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.41
LogP ≤ 56.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

4-methyl-2-(2-phenylethenyl)benzene-1,3-diol
CID 135318520
2-methyl-6-[(E)-2-phenylethenyl]phenol
CID 22713146
CID 172791684
CID 172791684
2-methyl-4,6-bis[(E)-2-phenylethenyl]phenol
CID 6071425
1-methyl-4-(2-phenylethenyl)naphthalene
CID 4283155
3-[[2,3-dihydroxy-4-[(E)-2-phenylethenyl]phenyl]diazenyl]-6-[(E)-2-phenylethenyl]benzene-1,2-diol
CID 137232949
2,4-dimethyl-1-[(E)-2-phenylethenyl]benzene
CID 15751246
but-2-enedioic acid;2,3,4-tris(2-phenylethenyl)phenol
CID 159401430
3-hydroxy-4-(2-phenylethenyl)cyclobut-3-ene-1,2-dione
CID 91203784
3-methyl-N,N-diphenyl-4-(2-phenylethenyl)aniline
CID 54520687
CID 67900431
CID 67900431
3-[5-hydroxy-2-(2-phenylethenyl)phenyl]-4-(2-phenylethenyl)phenol
CID 68866256

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2,3-bis(2-phenylethenyl)phenol?
The IUPAC name of 6-methyl-2,3-bis(2-phenylethenyl)phenol (CID 54059537) is 6-methyl-2,3-bis(2-phenylethenyl)phenol.
What is the SMILES notation for 6-methyl-2,3-bis(2-phenylethenyl)phenol?
The canonical SMILES for 6-methyl-2,3-bis(2-phenylethenyl)phenol is Cc1ccc(C=Cc2ccccc2)c(C=Cc2ccccc2)c1O.
What is the InChIKey of 6-methyl-2,3-bis(2-phenylethenyl)phenol?
The InChIKey is LYRIGBYMQMDVTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20O/c1-18-12-15-21(16-13-19-8-4-2-5-9-19)22(23(18)24)17-14-20-10-6-3-7-11-20/h2-17,24H,1H3.
What are the key properties of 6-methyl-2,3-bis(2-phenylethenyl)phenol?
6-methyl-2,3-bis(2-phenylethenyl)phenol has a molecular weight of 312.41 g/mol, XLogP of 6.04, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,3-bis(2-phenylethenyl)phenol is sourced from PubChem (CID 54059537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).