1,2-diphenylethenylbenzene;2-methylphenol

C27H24O — CID 159908422

IUPAC1,2-diphenylethenylbenzene;2-methylphenol
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccccc1.Cc1ccccc1O
InChIInChI=1S/C20H16.C7H8O/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19;1-6-4-2-3-5-7(6)8/h1-16H;2-5,8H,1H3
InChIKeyNWWGSSGKPNFMJY-UHFFFAOYSA-N
MW364.49 g/mol
LogP6.98
Rot. Bonds3

About 1,2-diphenylethenylbenzene;2-methylphenol

1,2-diphenylethenylbenzene;2-methylphenol (PubChem CID 159908422) has the molecular formula C27H24O and a molecular weight of 364.49 g/mol. Its IUPAC name is 1,2-diphenylethenylbenzene;2-methylphenol.

Molecular Properties

Compound Name1,2-diphenylethenylbenzene;2-methylphenol
PubChem CID159908422
Molecular FormulaC27H24O
Molecular Weight364.49 g/mol
Exact Mass364.18
IUPAC Name1,2-diphenylethenylbenzene;2-methylphenol
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccccc1.Cc1ccccc1O
InChIInChI=1S/C20H16.C7H8O/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19;1-6-4-2-3-5-7(6)8/h1-16H;2-5,8H,1H3
InChIKeyNWWGSSGKPNFMJY-UHFFFAOYSA-N
XLogP6.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.49
LogP ≤ 56.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1,2-diphenylethenylbenzene;2-methylphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 173126547
CID 173126547
CID 172843956
CID 172843956
1-[(E)-1,2-diphenylethenyl]-3,5-dimethylbenzene
CID 102283566
1-[(Z)-1,2-diphenylethenyl]-4-[4-[(Z)-1,2-diphenylethenyl]phenyl]benzene
CID 173002469
2-[(E)-1,2-diphenylethenyl]-1,3,5-trimethylbenzene
CID 12611498
1-(1,2-diphenylethenyl)-4-phenylbenzene
CID 54005685
1-[3-[(E)-1,2-diphenylethenyl]phenyl]ethanone
CID 121493701
1,4-bis[(E)-2-[4-(2,2-diphenylethenyl)phenyl]ethenyl]-2,5-dimethylbenzene
CID 20678111
1,4-bis[(E)-2-[4-(2,2-diphenylethenyl)phenyl]ethenyl]benzene
CID 20678091
1-chloro-4-(1,2-diphenylethenyl)benzene
CID 58695106
1,2-diphenylethenylbenzene;furan
CID 175372951
2-[2-[(E)-1,2-diphenylethenyl]-6-methylphenyl]pyridine
CID 101134171

Frequently Asked Questions

What is the IUPAC name of 1,2-diphenylethenylbenzene;2-methylphenol?
The IUPAC name of 1,2-diphenylethenylbenzene;2-methylphenol (CID 159908422) is 1,2-diphenylethenylbenzene;2-methylphenol.
What is the SMILES notation for 1,2-diphenylethenylbenzene;2-methylphenol?
The canonical SMILES for 1,2-diphenylethenylbenzene;2-methylphenol is C(=C(c1ccccc1)c1ccccc1)c1ccccc1.Cc1ccccc1O.
What is the InChIKey of 1,2-diphenylethenylbenzene;2-methylphenol?
The InChIKey is NWWGSSGKPNFMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16.C7H8O/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19;1-6-4-2-3-5-7(6)8/h1-16H;2-5,8H,1H3.
What are the key properties of 1,2-diphenylethenylbenzene;2-methylphenol?
1,2-diphenylethenylbenzene;2-methylphenol has a molecular weight of 364.49 g/mol, XLogP of 6.98, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenylethenylbenzene;2-methylphenol is sourced from PubChem (CID 159908422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).