3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene

C131H99N9 — CID 158272627

IUPAC3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene
SMILESCc1ccc(-c2ccc3c4c(cccc24)-c2ccccc2-3)cc1.Cc1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1.Cc1ccc2c(c1)c1ccccc1n2-c1nc(-c2ccccc2)c2ccccc2n1.Cc1ccc2c3c(cccc13)-c1ccccc1-2.Cc1cccc(-c2nc(-c3ccccc3)c3ccccc3n2)c1.Cc1ccccc1.Cc1nc(-c2ccccc2)c2ccccc2n1
InChIInChI=1S/C27H19N3.C23H16.2C21H16N2.C17H12.C15H12N2.C7H8/c1-18-15-16-25-22(17-18)20-11-6-8-14-24(20)30(25)27-28-23-13-7-5-12-21(23)26(29-27)19-9-3-2-4-10-19;1-15-9-11-16(12-10-15)17-13-14-22-19-6-3-2-5-18(19)21-8-4-7-20(17)23(21)22;1-15-8-7-11-17(14-15)21-22-19-13-6-5-12-18(19)20(23-21)16-9-3-2-4-10-16;1-15-11-13-17(14-12-15)21-22-19-10-6-5-9-18(19)20(23-21)16-7-3-2-4-8-16;1-11-9-10-16-14-6-3-2-5-13(14)15-8-4-7-12(11)17(15)16;1-11-16-14-10-6-5-9-13(14)15(17-11)12-7-3-2-4-8-12;1-7-5-3-2-4-6-7/h2-17H,1H3;3*2-14H,1H3;2*2-10H,1H3;2-6H,1H3
InChIKeyGJFMSRCHFKSEQQ-UHFFFAOYSA-N
MW1799.30 g/mol
LogP34.11
Rot. Bonds8

About 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene

3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene (PubChem CID 158272627) has the molecular formula C131H99N9 and a molecular weight of 1799.30 g/mol. Its IUPAC name is 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene.

Molecular Properties

Compound Name3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene
PubChem CID158272627
Molecular FormulaC131H99N9
Molecular Weight1799.30 g/mol
Exact Mass1797.80
IUPAC Name3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene
SMILESCc1ccc(-c2ccc3c4c(cccc24)-c2ccccc2-3)cc1.Cc1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1.Cc1ccc2c(c1)c1ccccc1n2-c1nc(-c2ccccc2)c2ccccc2n1.Cc1ccc2c3c(cccc13)-c1ccccc1-2.Cc1cccc(-c2nc(-c3ccccc3)c3ccccc3n2)c1.Cc1ccccc1.Cc1nc(-c2ccccc2)c2ccccc2n1
InChIInChI=1S/C27H19N3.C23H16.2C21H16N2.C17H12.C15H12N2.C7H8/c1-18-15-16-25-22(17-18)20-11-6-8-14-24(20)30(25)27-28-23-13-7-5-12-21(23)26(29-27)19-9-3-2-4-10-19;1-15-9-11-16(12-10-15)17-13-14-22-19-6-3-2-5-18(19)21-8-4-7-20(17)23(21)22;1-15-8-7-11-17(14-15)21-22-19-13-6-5-12-18(19)20(23-21)16-9-3-2-4-10-16;1-15-11-13-17(14-12-15)21-22-19-10-6-5-9-18(19)20(23-21)16-7-3-2-4-8-16;1-11-9-10-16-14-6-3-2-5-13(14)15-8-4-7-12(11)17(15)16;1-11-16-14-10-6-5-9-13(14)15(17-11)12-7-3-2-4-8-12;1-7-5-3-2-4-6-7/h2-17H,1H3;3*2-14H,1H3;2*2-10H,1H3;2-6H,1H3
InChIKeyGJFMSRCHFKSEQQ-UHFFFAOYSA-N
XLogP34.11
TPSA108.05 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms140
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001799.30
LogP ≤ 534.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene with MolForge

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Related Compounds

N,N-diphenyl-4-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]aniline;3-[9-[4-(4-methylphenyl)quinazolin-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(2-phenylquinazolin-4-yl)phenyl]carbazole
CID 161499770
9-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-methylcarbazol-4-yl]-3-methylcarbazole
CID 170367088
2-phenyl-9-[4-(4-phenylphenyl)quinazolin-2-yl]carbazole;9-(4-phenylquinazolin-2-yl)-3-triphenylen-2-ylcarbazole;9-phenyl-4-[4-(4-triphenylen-2-ylquinazolin-2-yl)phenyl]carbazole
CID 158204619
9-(4-tetraphenylen-2-ylquinazolin-2-yl)carbazole
CID 177109125
3-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole
CID 118067272
9-[3-(3,6-dimethylcarbazol-9-yl)-5-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-phenylquinazolin-2-yl)carbazole;9-[3-(4-phenylquinazolin-2-yl)phenyl]carbazole
CID 161266097
27-(4-phenylquinazolin-2-yl)-27-azaheptacyclo[12.11.1.16,9.02,7.08,13.016,21.022,26]heptacosa-1(25),2(7),3,5,8(13),9,11,14,16,18,20,22(26),23-tridecaene
CID 164840623
9-[4-(4-phenylquinazolin-2-yl)phenyl]-9-azahexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene
CID 118301183
23-(4-dibenzofuran-2-ylquinazolin-2-yl)-17-phenyl-23-azahexacyclo[12.7.1.16,9.02,7.08,13.018,22]tricosa-1(21),2(7),3,5,8(13),9,11,14(22),15,17,19-undecaene
CID 164840647
3-[9-(4-methylphenyl)carbazol-2-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole
CID 90129286
3-(9-phenylcarbazol-3-yl)-9-(2-phenylquinazolin-4-yl)carbazole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(2-phenylquinazolin-4-yl)phenyl]carbazole
CID 160822067
19-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]-8-oxa-1-azahexacyclo[11.9.1.114,18.02,7.09,23.022,24]tetracosa-2,4,6,9,11,13(23),14(24),15,17,19,21-undecaene
CID 135280177

Frequently Asked Questions

What is the IUPAC name of 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene?
The IUPAC name of 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene (CID 158272627) is 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene.
What is the SMILES notation for 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene?
The canonical SMILES for 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene is Cc1ccc(-c2ccc3c4c(cccc24)-c2ccccc2-3)cc1.Cc1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1.Cc1ccc2c(c1)c1ccccc1n2-c1nc(-c2ccccc2)c2ccccc2n1.Cc1ccc2c3c(cccc13)-c1ccccc1-2.Cc1cccc(-c2nc(-c3ccccc3)c3ccccc3n2)c1.Cc1ccccc1.Cc1nc(-c2ccccc2)c2ccccc2n1.
What is the InChIKey of 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene?
The InChIKey is GJFMSRCHFKSEQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H19N3.C23H16.2C21H16N2.C17H12.C15H12N2.C7H8/c1-18-15-16-25-22(17-18)20-11-6-8-14-24(20)30(25)27-28-23-13-7-5-12-21(23)26(29-27)19-9-3-2-4-10-19;1-15-9-11-16(12-10-15)17-13-14-22-19-6-3-2-5-18(19)21-8-4-7-20(17)23(21)22;1-15-8-7-11-17(14-15)21-22-19-13-6-5-12-18(19)20(23-21)16-9-3-2-4-10-16;1-15-11-13-17(14-12-15)21-22-19-10-6-5-9-18(19)20(23-21)16-7-3-2-4-8-16;1-11-9-10-16-14-6-3-2-5-13(14)15-8-4-7-12(11)17(15)16;1-11-16-14-10-6-5-9-13(14)15(17-11)12-7-3-2-4-8-12;1-7-5-3-2-4-6-7/h2-17H,1H3;3*2-14H,1H3;2*2-10H,1H3;2-6H,1H3.
What are the key properties of 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene?
3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene has a molecular weight of 1799.30 g/mol, XLogP of 34.11, 8 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene is sourced from PubChem (CID 158272627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).