9-methyl-10-(3-phenylprop-2-enyl)anthracene

C24H20 — CID 156901579

IUPAC9-methyl-10-(3-phenylprop-2-enyl)anthracene
SMILESCc1c2ccccc2c(CC=Cc2ccccc2)c2ccccc12
InChIInChI=1S/C24H20/c1-18-20-13-5-7-15-22(20)24(23-16-8-6-14-21(18)23)17-9-12-19-10-3-2-4-11-19/h2-16H,17H2,1H3
InChIKeyYBBDUSODBHEZJE-UHFFFAOYSA-N
MW308.42 g/mol
LogP6.56
Rot. Bonds3

About 9-methyl-10-(3-phenylprop-2-enyl)anthracene

9-methyl-10-(3-phenylprop-2-enyl)anthracene (PubChem CID 156901579) has the molecular formula C24H20 and a molecular weight of 308.42 g/mol. Its IUPAC name is 9-methyl-10-(3-phenylprop-2-enyl)anthracene.

Molecular Properties

Compound Name9-methyl-10-(3-phenylprop-2-enyl)anthracene
PubChem CID156901579
Molecular FormulaC24H20
Molecular Weight308.42 g/mol
Exact Mass308.16
IUPAC Name9-methyl-10-(3-phenylprop-2-enyl)anthracene
SMILESCc1c2ccccc2c(CC=Cc2ccccc2)c2ccccc12
InChIInChI=1S/C24H20/c1-18-20-13-5-7-15-22(20)24(23-16-8-6-14-21(18)23)17-9-12-19-10-3-2-4-11-19/h2-16H,17H2,1H3
InChIKeyYBBDUSODBHEZJE-UHFFFAOYSA-N
XLogP6.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.42
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

3,5-dimethyl-2-[(E)-3-phenylprop-2-enyl]benzene-1,4-diol
CID 59639128
ethane;[(E)-3-phenylprop-1-enyl]benzene
CID 143041114
3,5-dimethyl-2-[(E)-3-phenylprop-2-enyl]phenol
CID 162361453
[(1E)-5-phenylpenta-1,4-dienyl]benzene
CID 91021368
3-phenylprop-1-enylbenzene;tetrahydrofluoride
CID 174822249
1-(3-phenylprop-2-enyl)naphthalene-2-carboxylic acid
CID 162681591
benzene;but-1-enylbenzene
CID 157481332
2-[(E)-3-phenylprop-2-enyl]-1,3,5-tri(propan-2-yl)benzene
CID 102406113
2-methyl-4-[(E)-3-phenylprop-2-enyl]benzene-1,3-diol
CID 14224897
6,8-dimethyl-7-(3-phenylprop-2-enyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 4314110
1,4-dimethyl-2-[(E)-3-phenylprop-2-enyl]benzene
CID 11746215
2-methyl-5-(3-phenylprop-2-enyl)-1,3,4-oxadiazole
CID 68949565

Frequently Asked Questions

What is the IUPAC name of 9-methyl-10-(3-phenylprop-2-enyl)anthracene?
The IUPAC name of 9-methyl-10-(3-phenylprop-2-enyl)anthracene (CID 156901579) is 9-methyl-10-(3-phenylprop-2-enyl)anthracene.
What is the SMILES notation for 9-methyl-10-(3-phenylprop-2-enyl)anthracene?
The canonical SMILES for 9-methyl-10-(3-phenylprop-2-enyl)anthracene is Cc1c2ccccc2c(CC=Cc2ccccc2)c2ccccc12.
What is the InChIKey of 9-methyl-10-(3-phenylprop-2-enyl)anthracene?
The InChIKey is YBBDUSODBHEZJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20/c1-18-20-13-5-7-15-22(20)24(23-16-8-6-14-21(18)23)17-9-12-19-10-3-2-4-11-19/h2-16H,17H2,1H3.
What are the key properties of 9-methyl-10-(3-phenylprop-2-enyl)anthracene?
9-methyl-10-(3-phenylprop-2-enyl)anthracene has a molecular weight of 308.42 g/mol, XLogP of 6.56, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-10-(3-phenylprop-2-enyl)anthracene is sourced from PubChem (CID 156901579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).