3,4-dimethyl-11H-benzo[b]fluorene

C19H16 — CID 159162608

IUPAC3,4-dimethyl-11H-benzo[b]fluorene
SMILESCc1ccc2c(c1C)-c1cc3ccccc3cc1C2
InChIInChI=1S/C19H16/c1-12-7-8-16-10-17-9-14-5-3-4-6-15(14)11-18(17)19(16)13(12)2/h3-9,11H,10H2,1-2H3
InChIKeyGJVOJNCGAYEZOQ-UHFFFAOYSA-N
MW244.34 g/mol
LogP5.03
Rot. Bonds

About 3,4-dimethyl-11H-benzo[b]fluorene

3,4-dimethyl-11H-benzo[b]fluorene (PubChem CID 159162608) has the molecular formula C19H16 and a molecular weight of 244.34 g/mol. Its IUPAC name is 3,4-dimethyl-11H-benzo[b]fluorene.

Molecular Properties

Compound Name3,4-dimethyl-11H-benzo[b]fluorene
PubChem CID159162608
Molecular FormulaC19H16
Molecular Weight244.34 g/mol
Exact Mass244.13
IUPAC Name3,4-dimethyl-11H-benzo[b]fluorene
SMILESCc1ccc2c(c1C)-c1cc3ccccc3cc1C2
InChIInChI=1S/C19H16/c1-12-7-8-16-10-17-9-14-5-3-4-6-15(14)11-18(17)19(16)13(12)2/h3-9,11H,10H2,1-2H3
InChIKeyGJVOJNCGAYEZOQ-UHFFFAOYSA-N
XLogP5.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500244.34
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

nonacyclo[19.16.0.03,19.04,17.06,15.08,13.023,36.025,34.027,32]heptatriaconta-1(37),2,4,6,8,10,12,14,16,19,21,23,25,27,29,31,33,35-octadecaene
CID 59787194
1,2-dimethyl-9H-fluorene;2,3-dimethyl-9H-fluorene;3,4-dimethyl-9H-fluorene
CID 159443497
bis(1,2-dimethyl-9H-fluorene);bis(2,3-dimethyl-9H-fluorene);3,4-dimethyl-9H-fluorene
CID 163707739
1H-cyclopropa[b]naphthalene;ethane
CID 144907572
hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,22-undecaene
CID 58250867
bis(7,8,9-trimethyl-11H-benzo[a]fluorene);1,2,3-trimethyl-11H-benzo[b]fluorene;2,3,4-trimethyl-11H-benzo[b]fluorene;8,9,10-trimethyl-7H-benzo[c]fluorene;9,10,11-trimethyl-7H-benzo[c]fluorene
CID 163500234
8,9-dimethyl-7H-benzo[c]fluorene
CID 159520619
2-(11H-benzo[b]fluoren-4-ylmethyl)-4,6-diethyl-1,3,5-triazine
CID 160729817
8,9-dimethyl-11H-benzo[a]fluorene;2,3-dimethyl-11H-benzo[b]fluorene;9,10-dimethyl-7H-benzo[c]fluorene;8,9-dimethyl-2,3,4,11-tetrahydro-1H-benzo[a]fluorene;ethane
CID 159294979
3-methyl-1H-cyclopenta[b]naphthalene-2-carbaldehyde
CID 102097914
5,7,14,16-tetrahydrohexacene
CID 139940246
tetracyclo[8.6.0.03,8.011,15]hexadeca-1,3,5,7,9,11(15),12-heptaene
CID 157096961

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-11H-benzo[b]fluorene?
The IUPAC name of 3,4-dimethyl-11H-benzo[b]fluorene (CID 159162608) is 3,4-dimethyl-11H-benzo[b]fluorene.
What is the SMILES notation for 3,4-dimethyl-11H-benzo[b]fluorene?
The canonical SMILES for 3,4-dimethyl-11H-benzo[b]fluorene is Cc1ccc2c(c1C)-c1cc3ccccc3cc1C2.
What is the InChIKey of 3,4-dimethyl-11H-benzo[b]fluorene?
The InChIKey is GJVOJNCGAYEZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16/c1-12-7-8-16-10-17-9-14-5-3-4-6-15(14)11-18(17)19(16)13(12)2/h3-9,11H,10H2,1-2H3.
What are the key properties of 3,4-dimethyl-11H-benzo[b]fluorene?
3,4-dimethyl-11H-benzo[b]fluorene has a molecular weight of 244.34 g/mol, XLogP of 5.03, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-11H-benzo[b]fluorene is sourced from PubChem (CID 159162608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).