1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene

C95H94 — CID 158743052

IUPAC1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene
SMILESCc1cc(C)c2c(c1C)Cc1ccccc1-2.Cc1cc2c(c(C)c1C)Cc1ccccc1-2.Cc1ccc2c(c1)-c1ccc(C)c(C)c1C2.Cc1ccc2c(c1)Cc1c-2ccc(C)c1C.Cc1ccc2c(c1C)Cc1cccc(C)c1-2.Cc1ccc2c(c1C)Cc1ccccc1-2
InChIInChI=1S/5C16H16.C15H14/c1-10-4-6-14-13(8-10)9-16-12(3)11(2)5-7-15(14)16;1-10-4-6-13-9-15-12(3)11(2)5-7-14(15)16(13)8-10;1-10-7-8-14-15(12(10)3)9-13-6-4-5-11(2)16(13)14;1-10-8-16-14-7-5-4-6-13(14)9-15(16)12(3)11(10)2;1-10-8-11(2)16-14-7-5-4-6-13(14)9-15(16)12(10)3;1-10-7-8-14-13-6-4-3-5-12(13)9-15(14)11(10)2/h5*4-8H,9H2,1-3H3;3-8H,9H2,1-2H3
InChIKeyIMNSSTXCETUGNR-UHFFFAOYSA-N
MW1235.80 g/mol
LogP24.79
Rot. Bonds

About 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene

1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene (PubChem CID 158743052) has the molecular formula C95H94 and a molecular weight of 1235.80 g/mol. Its IUPAC name is 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene.

Molecular Properties

Compound Name1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene
PubChem CID158743052
Molecular FormulaC95H94
Molecular Weight1235.80 g/mol
Exact Mass1234.74
IUPAC Name1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene
SMILESCc1cc(C)c2c(c1C)Cc1ccccc1-2.Cc1cc2c(c(C)c1C)Cc1ccccc1-2.Cc1ccc2c(c1)-c1ccc(C)c(C)c1C2.Cc1ccc2c(c1)Cc1c-2ccc(C)c1C.Cc1ccc2c(c1C)Cc1cccc(C)c1-2.Cc1ccc2c(c1C)Cc1ccccc1-2
InChIInChI=1S/5C16H16.C15H14/c1-10-4-6-14-13(8-10)9-16-12(3)11(2)5-7-15(14)16;1-10-4-6-13-9-15-12(3)11(2)5-7-14(15)16(13)8-10;1-10-7-8-14-15(12(10)3)9-13-6-4-5-11(2)16(13)14;1-10-8-16-14-7-5-4-6-13(14)9-15(16)12(3)11(10)2;1-10-8-11(2)16-14-7-5-4-6-13(14)9-15(16)12(10)3;1-10-7-8-14-13-6-4-3-5-12(13)9-15(14)11(10)2/h5*4-8H,9H2,1-3H3;3-8H,9H2,1-2H3
InChIKeyIMNSSTXCETUGNR-UHFFFAOYSA-N
XLogP24.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms95
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001235.80
LogP ≤ 524.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene?
The IUPAC name of 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene (CID 158743052) is 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene.
What is the SMILES notation for 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene?
The canonical SMILES for 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene is Cc1cc(C)c2c(c1C)Cc1ccccc1-2.Cc1cc2c(c(C)c1C)Cc1ccccc1-2.Cc1ccc2c(c1)-c1ccc(C)c(C)c1C2.Cc1ccc2c(c1)Cc1c-2ccc(C)c1C.Cc1ccc2c(c1C)Cc1cccc(C)c1-2.Cc1ccc2c(c1C)Cc1ccccc1-2.
What is the InChIKey of 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene?
The InChIKey is IMNSSTXCETUGNR-UHFFFAOYSA-N. The full InChI is InChI=1S/5C16H16.C15H14/c1-10-4-6-14-13(8-10)9-16-12(3)11(2)5-7-15(14)16;1-10-4-6-13-9-15-12(3)11(2)5-7-14(15)16(13)8-10;1-10-7-8-14-15(12(10)3)9-13-6-4-5-11(2)16(13)14;1-10-8-16-14-7-5-4-6-13(14)9-15(16)12(3)11(10)2;1-10-8-11(2)16-14-7-5-4-6-13(14)9-15(16)12(10)3;1-10-7-8-14-13-6-4-3-5-12(13)9-15(14)11(10)2/h5*4-8H,9H2,1-3H3;3-8H,9H2,1-2H3.
What are the key properties of 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene?
1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene has a molecular weight of 1235.80 g/mol, XLogP of 24.79, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-9H-fluorene;1,2,3-trimethyl-9H-fluorene;1,2,4-trimethyl-9H-fluorene;1,2,5-trimethyl-9H-fluorene;1,2,6-trimethyl-9H-fluorene;1,2,7-trimethyl-9H-fluorene is sourced from PubChem (CID 158743052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).