8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene

C29H22 — CID 91553402

IUPAC8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene
SMILESCc1cc(-c2ccccc2)c2c(c1-c1ccccc1)C1=CC=CC3C=CC=C2C13
InChIInChI=1S/C29H22/c1-19-18-25(20-10-4-2-5-11-20)28-23-16-8-14-22-15-9-17-24(27(22)23)29(28)26(19)21-12-6-3-7-13-21/h2-18,22,27H,1H3
InChIKeyMESITPIRWMJFLO-UHFFFAOYSA-N
MW370.50 g/mol
LogP7.48
Rot. Bonds2

About 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene

8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene (PubChem CID 91553402) has the molecular formula C29H22 and a molecular weight of 370.50 g/mol. Its IUPAC name is 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene.

Molecular Properties

Compound Name8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene
PubChem CID91553402
Molecular FormulaC29H22
Molecular Weight370.50 g/mol
Exact Mass370.17
IUPAC Name8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene
SMILESCc1cc(-c2ccccc2)c2c(c1-c1ccccc1)C1=CC=CC3C=CC=C2C13
InChIInChI=1S/C29H22/c1-19-18-25(20-10-4-2-5-11-20)28-23-16-8-14-22-15-9-17-24(27(22)23)29(28)26(19)21-12-6-3-7-13-21/h2-18,22,27H,1H3
InChIKeyMESITPIRWMJFLO-UHFFFAOYSA-N
XLogP7.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.50
LogP ≤ 57.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

5-(4-naphthalen-1-ylphenyl)-3,6-diphenylpentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8,10,14,16-octaene
CID 123765532
chloro-tris(6-methyl-2,3,4-triphenylphenyl)silane
CID 88962348
methane;1,2,3,4,5-pentakis-phenylbenzene;1,2,4,5-tetraphenylbenzene
CID 161142859
2-methyl-4-(4-methylphenyl)-1-phenylnaphthalene
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methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene
CID 142335654
5,23-bis(2-methylphenyl)decacyclo[25.7.1.17,11.02,26.04,24.06,22.08,21.09,18.010,15.031,35]hexatriaconta-1(34),2(26),3,5,7(36),8(21),9(18),10(15),11,13,16,19,22,24,27,29,32-heptadecaene
CID 123521813
1,2,5-trimethyl-3,4-diphenylbenzene
CID 19420158
9-(3-methyl-4-phenylnaphthalen-1-yl)-10-phenylanthracene
CID 140762183
2,7-dimethyl-1,4-diphenylnaphthalene
CID 46919192
1-methyl-3,5-diphenyl-2,4-bis(trifluoromethyl)benzene
CID 173305938
4-methyl-2,6-diphenylbenzene-1,3-diamine
CID 174990680
2,3-diphenylbicyclo[3.1.0]hexa-1(6),2,4-triene
CID 19931086

Frequently Asked Questions

What is the IUPAC name of 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene?
The IUPAC name of 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene (CID 91553402) is 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene.
What is the SMILES notation for 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene?
The canonical SMILES for 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene is Cc1cc(-c2ccccc2)c2c(c1-c1ccccc1)C1=CC=CC3C=CC=C2C13.
What is the InChIKey of 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene?
The InChIKey is MESITPIRWMJFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H22/c1-19-18-25(20-10-4-2-5-11-20)28-23-16-8-14-22-15-9-17-24(27(22)23)29(28)26(19)21-12-6-3-7-13-21/h2-18,22,27H,1H3.
What are the key properties of 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene?
8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene has a molecular weight of 370.50 g/mol, XLogP of 7.48, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-7,10-diphenyl-3a,10c-dihydrofluoranthene is sourced from PubChem (CID 91553402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).