5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene

C39H30 — CID 59575154

IUPAC5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene
SMILESCC(=Cc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(C)c3ccccc3c1-2)c1ccccc1
InChIInChI=1S/C39H30/c1-27(30-14-6-3-7-15-30)24-29-22-23-35-36(26-29)39(31-16-8-4-9-17-31,32-18-10-5-11-19-32)37-25-28(2)33-20-12-13-21-34(33)38(35)37/h3-26H,1-2H3
InChIKeyDJNLMPJGQPFYIK-UHFFFAOYSA-N
MW498.67 g/mol
LogP10.07
Rot. Bonds4

About 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene

5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene (PubChem CID 59575154) has the molecular formula C39H30 and a molecular weight of 498.67 g/mol. Its IUPAC name is 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene.

Molecular Properties

Compound Name5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene
PubChem CID59575154
Molecular FormulaC39H30
Molecular Weight498.67 g/mol
Exact Mass498.23
IUPAC Name5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene
SMILESCC(=Cc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(C)c3ccccc3c1-2)c1ccccc1
InChIInChI=1S/C39H30/c1-27(30-14-6-3-7-15-30)24-29-22-23-35-36(26-29)39(31-16-8-4-9-17-31,32-18-10-5-11-19-32)37-25-28(2)33-20-12-13-21-34(33)38(35)37/h3-26H,1-2H3
InChIKeyDJNLMPJGQPFYIK-UHFFFAOYSA-N
XLogP10.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500498.67
LogP ≤ 510.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

5-bromo-9-methyl-7,7-diphenylbenzo[c]fluorene
CID 142714191
9-methyl-7,7-diphenylbenzo[c]fluorene-5-carbonitrile
CID 144613202
7,7-bis(4-hexylphenyl)-5,9-dimethylbenzo[c]fluorene
CID 140661825
7,7-diphenyl-5,9-bis[4-[3-(3-phenylphenyl)phenyl]phenyl]benzo[c]fluorene
CID 59755297
7,7-diphenyl-5,9-bis[3-(3-phenylphenyl)phenyl]benzo[c]fluorene
CID 59755365
1-[1-(5-methyl-7,7-diphenylbenzo[g]fluoren-9-yl)propan-2-yl]dibenzothiophene
CID 144614094
9,9-bis[4-(4-chlorophenyl)phenyl]-2,7-bis(2,2-diphenylethenyl)fluorene
CID 22932221
9-methyl-5-(4-naphthalen-2-ylphenyl)-7,7-diphenylbenzo[c]fluorene
CID 59755354
2-(2,2-diphenylethenyl)-9,9'-spirobi[fluorene]
CID 102477561
5,7,7,9-tetramethylbenzo[c]fluorene
CID 59595492
4-methyl-N-(4-methylphenyl)-N-[4-[9,19,22,22-tetramethyl-12-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-12-hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16(21),17,19,23-undecaenyl]phenyl]aniline
CID 90244035
2-ethenyl-9,9-diphenylfluorene
CID 144583514

Frequently Asked Questions

What is the IUPAC name of 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene?
The IUPAC name of 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene (CID 59575154) is 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene.
What is the SMILES notation for 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene?
The canonical SMILES for 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene is CC(=Cc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(C)c3ccccc3c1-2)c1ccccc1.
What is the InChIKey of 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene?
The InChIKey is DJNLMPJGQPFYIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H30/c1-27(30-14-6-3-7-15-30)24-29-22-23-35-36(26-29)39(31-16-8-4-9-17-31,32-18-10-5-11-19-32)37-25-28(2)33-20-12-13-21-34(33)38(35)37/h3-26H,1-2H3.
What are the key properties of 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene?
5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene has a molecular weight of 498.67 g/mol, XLogP of 10.07, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-7,7-diphenyl-9-(2-phenylprop-1-enyl)benzo[c]fluorene is sourced from PubChem (CID 59575154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).