fluoranthene;toluene

C23H18 — CID 173324369

IUPACfluoranthene;toluene
SMILESCc1ccccc1.c1ccc2c(c1)-c1cccc3cccc-2c13
InChIInChI=1S/C16H10.C7H8/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14;1-7-5-3-2-4-6-7/h1-10H;2-6H,1H3
InChIKeyPZCRYFWVLBCERS-UHFFFAOYSA-N
MW294.40 g/mol
LogP6.48
Rot. Bonds

About fluoranthene;toluene

fluoranthene;toluene (PubChem CID 173324369) has the molecular formula C23H18 and a molecular weight of 294.40 g/mol. Its IUPAC name is fluoranthene;toluene.

Molecular Properties

Compound Namefluoranthene;toluene
PubChem CID173324369
Molecular FormulaC23H18
Molecular Weight294.40 g/mol
Exact Mass294.14
IUPAC Namefluoranthene;toluene
SMILESCc1ccccc1.c1ccc2c(c1)-c1cccc3cccc-2c13
InChIInChI=1S/C16H10.C7H8/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14;1-7-5-3-2-4-6-7/h1-10H;2-6H,1H3
InChIKeyPZCRYFWVLBCERS-UHFFFAOYSA-N
XLogP6.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.40
LogP ≤ 56.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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benzo[k]fluoranthene;ethane
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benzo[a]phenalen-7-one;ethane
CID 90765972
benzene;toluene
CID 158487474
methylcyclotriacontapentadecaene
CID 101240530
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CID 22023820
7,12-bis(4-methylphenyl)-8,11-diphenylbenzo[k]fluoranthene
CID 158890209
anthracene-9,10-dione;benzo[a]phenalen-7-one
CID 157197753
7,12-dimethylpleiadene
CID 132501429
4-methyl-3-azatetracyclo[9.7.1.02,10.015,19]nonadeca-1(18),2(10),4,6,8,11,13,15(19),16-nonaene
CID 145321999

Frequently Asked Questions

What is the IUPAC name of fluoranthene;toluene?
The IUPAC name of fluoranthene;toluene (CID 173324369) is fluoranthene;toluene.
What is the SMILES notation for fluoranthene;toluene?
The canonical SMILES for fluoranthene;toluene is Cc1ccccc1.c1ccc2c(c1)-c1cccc3cccc-2c13.
What is the InChIKey of fluoranthene;toluene?
The InChIKey is PZCRYFWVLBCERS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10.C7H8/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14;1-7-5-3-2-4-6-7/h1-10H;2-6H,1H3.
What are the key properties of fluoranthene;toluene?
fluoranthene;toluene has a molecular weight of 294.40 g/mol, XLogP of 6.48, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for fluoranthene;toluene is sourced from PubChem (CID 173324369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).