1,3,7-trimethyl-9H-fluorene

C16H16 — CID 59561098

IUPAC1,3,7-trimethyl-9H-fluorene
SMILESCc1ccc2c(c1)Cc1c(C)cc(C)cc1-2
InChIInChI=1S/C16H16/c1-10-4-5-14-13(7-10)9-15-12(3)6-11(2)8-16(14)15/h4-8H,9H2,1-3H3
InChIKeyUYRFTCJYDMPGCQ-UHFFFAOYSA-N
MW208.30 g/mol
LogP4.18
Rot. Bonds

About 1,3,7-trimethyl-9H-fluorene

1,3,7-trimethyl-9H-fluorene (PubChem CID 59561098) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1,3,7-trimethyl-9H-fluorene.

Molecular Properties

Compound Name1,3,7-trimethyl-9H-fluorene
PubChem CID59561098
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name1,3,7-trimethyl-9H-fluorene
SMILESCc1ccc2c(c1)Cc1c(C)cc(C)cc1-2
InChIInChI=1S/C16H16/c1-10-4-5-14-13(7-10)9-15-12(3)6-11(2)8-16(14)15/h4-8H,9H2,1-3H3
InChIKeyUYRFTCJYDMPGCQ-UHFFFAOYSA-N
XLogP4.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,3,6-trimethyl-9H-fluorene
CID 59560956
1,3,6,7-tetramethyl-9H-fluorene
CID 59561051
1,3-dimethyl-11,12-dihydroindeno[2,1-a]fluorene
CID 59147149
2,9-dimethyl-11,12-dihydroindeno[2,1-a]fluorene;2,8-dimethyl-6,12-dihydroindeno[1,2-b]fluorene
CID 159175556
bis(2,7-dimethyl-9H-fluorene);ethane;methane
CID 159270379
10,27-dimethylnonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1,3(18),4,6(14),8(13),9,11,15,19,21,23(31),25(30),26,28,32-pentadecaene
CID 157144570
2-methyl-11,12-dihydroindeno[2,1-a]fluorene
CID 91412368
dichlorozirconium;2,7-dimethyl-9H-fluorene
CID 174320466
carbanide;ethane;bis(5,7,16-trimethylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene);bis(5,7,18-trimethylpentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene);(yttrium)
CID 157433703
2,7-dimethyl-9,10-dihydrophenanthrene
CID 23550290
2,7-dimethyl-6,12-dihydroindeno[1,2-b]fluorene;2,8-dimethyl-6,12-dihydroindeno[1,2-b]fluorene;2,9-dimethyl-6,12-dihydroindeno[1,2-b]fluorene;bis(2-methyl-7-(3-methylphenyl)-9H-fluorene);bis(2-methyl-7-(4-methylphenyl)-9H-fluorene);6-methyl-2-(3-methylphenyl)-9H-fluorene;6-methyl-2-(4-methylphenyl)-9H-fluorene
CID 159386502
2-bromo-7-methyl-9H-fluorene
CID 21041918

Frequently Asked Questions

What is the IUPAC name of 1,3,7-trimethyl-9H-fluorene?
The IUPAC name of 1,3,7-trimethyl-9H-fluorene (CID 59561098) is 1,3,7-trimethyl-9H-fluorene.
What is the SMILES notation for 1,3,7-trimethyl-9H-fluorene?
The canonical SMILES for 1,3,7-trimethyl-9H-fluorene is Cc1ccc2c(c1)Cc1c(C)cc(C)cc1-2.
What is the InChIKey of 1,3,7-trimethyl-9H-fluorene?
The InChIKey is UYRFTCJYDMPGCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16/c1-10-4-5-14-13(7-10)9-15-12(3)6-11(2)8-16(14)15/h4-8H,9H2,1-3H3.
What are the key properties of 1,3,7-trimethyl-9H-fluorene?
1,3,7-trimethyl-9H-fluorene has a molecular weight of 208.30 g/mol, XLogP of 4.18, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,7-trimethyl-9H-fluorene is sourced from PubChem (CID 59561098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).